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Carbonylforbindelser

Organiske forbindelser, der indeholder en eller flere carbonyl (et carbonatom med en dobbeltbinding til et oxygenatom) funktionelle grupper. Omfatter forbindelser med funktionelle grupper, der indeholder en carbonyl i deres struktur, såsom ketoner, aldehyder og andre.
Acyloiner (6)
Alfa-beta-umættede carbonylforbindelser (56)
Dicarbonylforbindelser (59)
Komplekse aldehyder (273)
Komplekse ketoner (322)

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1

Alizarin-3-methyliminodieddikesyre, 85 %, Honeywell Fluka™

CAS: 3952-78-1 Molekylær formel: C19H15NO8 Molekylvægt (g/mol): 385.328 MDL nummer: MFCD00001202 InChI nøgle: PWIGYBONXWGOQE-UHFFFAOYSA-N Synonym: alizarin complexone,alizarin fluorine blue,alizarin complexon,alizarine complexon,alizarine complexone,alizarinkomplexon,alizarine fluorine blue,3-aminomethylalizarin-n,n-diacetic acid,az-c,alizarin-3-methyliminodiacetic acid PubChem CID: 65132 ChEBI: CHEBI:53088 IUPAC navn: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxoanthracen-2-yl)methyl]amino]eddikesyre SMIL: C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O

MDL nummer MFCD00001202
PubChem CID 65132
Molekylvægt (g/mol) 385.328
CAS 3952-78-1
ChEBI CHEBI:53088
Synonym alizarin complexone,alizarin fluorine blue,alizarin complexon,alizarine complexon,alizarine complexone,alizarinkomplexon,alizarine fluorine blue,3-aminomethylalizarin-n,n-diacetic acid,az-c,alizarin-3-methyliminodiacetic acid
SMIL C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O
IUPAC navn 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxoanthracen-2-yl)methyl]amino]eddikesyre
InChI nøgle PWIGYBONXWGOQE-UHFFFAOYSA-N
Molekylær formel C19H15NO8
2
Kampagner er tilgængelige

tert-butylacetoacetat, 97 %, Thermo Scientific Chemicals

CAS: 1694-31-1 Molekylær formel: C8H14O3 Molekylvægt (g/mol): 158.2 MDL nummer: MFCD00008811 InChI nøgle: JKUYRAMKJLMYLO-UHFFFAOYSA-N Synonym: tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate PubChem CID: 15538 IUPAC navn: tert-butyl-3-oxobutanoat SMIL: CC(=O)CC(=O)OC(C)(C)C

EDGE
MDL nummer MFCD00008811
PubChem CID 15538
Molekylvægt (g/mol) 158.2
CAS 1694-31-1
Synonym tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate
SMIL CC(=O)CC(=O)OC(C)(C)C
IUPAC navn tert-butyl-3-oxobutanoat
InChI nøgle JKUYRAMKJLMYLO-UHFFFAOYSA-N
Molekylær formel C8H14O3
3
Kampagner er tilgængelige

5-methylfurfural, 98+%, Thermo Scientific Chemicals

CAS: 620-02-0 Molekylær formel: C6H6O2 Molekylvægt (g/mol): 110.11 MDL nummer: MFCD00003232 InChI nøgle: OUDFNZMQXZILJD-UHFFFAOYSA-N Synonym: 5-methylfurfural,5-methyl-2-furaldehyde,5-methyl furfural,5-methyl-2-furfural,2-furancarboxaldehyde, 5-methyl,5-methylfuran-2-al,5-methyl-2-furancarboxaldehyde,5-methylfurfuraldehyde,2-furaldehyde, 5-methyl,2-formyl-5-methylfuran PubChem CID: 12097 ChEBI: CHEBI:2091 IUPAC navn: 5-methylfuran-2-carbaldehyd SMIL: CC1=CC=C(O1)C=O

EDGE
MDL nummer MFCD00003232
PubChem CID 12097
Molekylvægt (g/mol) 110.11
CAS 620-02-0
ChEBI CHEBI:2091
Synonym 5-methylfurfural,5-methyl-2-furaldehyde,5-methyl furfural,5-methyl-2-furfural,2-furancarboxaldehyde, 5-methyl,5-methylfuran-2-al,5-methyl-2-furancarboxaldehyde,5-methylfurfuraldehyde,2-furaldehyde, 5-methyl,2-formyl-5-methylfuran
SMIL CC1=CC=C(O1)C=O
IUPAC navn 5-methylfuran-2-carbaldehyd
InChI nøgle OUDFNZMQXZILJD-UHFFFAOYSA-N
Molekylær formel C6H6O2
4
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Ethyl acetoacetate, 99%, pure

CAS: 141-97-9 Molekylær formel: C6H10O3 Molekylvægt (g/mol): 130.14 MDL nummer: MFCD00009199 InChI nøgle: XYIBRDXRRQCHLP-UHFFFAOYSA-N Synonym: ethyl acetoacetate,ethyl acetylacetate,ethyl 3-oxobutyrate,diacetic ether,butanoic acid, 3-oxo-, ethyl ester,ethyl acetylacetonate,acetoacetic acid, ethyl ester,3-oxobutanoic acid ethyl ester,3-oxo-butyric acid ethyl ester,active acetylacetate PubChem CID: 8868 ChEBI: CHEBI:4893 IUPAC navn: ethyl-3-oxobutanoat SMIL: CCOC(=O)CC(=O)C

EDGE
MDL nummer MFCD00009199
PubChem CID 8868
Molekylvægt (g/mol) 130.14
CAS 141-97-9
ChEBI CHEBI:4893
Synonym ethyl acetoacetate,ethyl acetylacetate,ethyl 3-oxobutyrate,diacetic ether,butanoic acid, 3-oxo-, ethyl ester,ethyl acetylacetonate,acetoacetic acid, ethyl ester,3-oxobutanoic acid ethyl ester,3-oxo-butyric acid ethyl ester,active acetylacetate
SMIL CCOC(=O)CC(=O)C
IUPAC navn ethyl-3-oxobutanoat
InChI nøgle XYIBRDXRRQCHLP-UHFFFAOYSA-N
Molekylær formel C6H10O3
5
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Acetophenone, 98%, pure

CAS: 98-86-2 MDL nummer: MFCD00008724 InChI nøgle: KWOLFJPFCHCOCG-UHFFFAOYSA-N Synonym: acetophenone,methyl phenyl ketone,acetylbenzene,phenyl methyl ketone,ethanone, 1-phenyl,hypnone,benzoyl methide,acetophenon,1-phenylethan-1-one,acetylbenzol PubChem CID: 7410 ChEBI: CHEBI:27632 IUPAC navn: 1-phenylethanon SMIL: CC(=O)C1=CC=CC=C1

EDGE
MDL nummer MFCD00008724
PubChem CID 7410
CAS 98-86-2
ChEBI CHEBI:27632
Synonym acetophenone,methyl phenyl ketone,acetylbenzene,phenyl methyl ketone,ethanone, 1-phenyl,hypnone,benzoyl methide,acetophenon,1-phenylethan-1-one,acetylbenzol
SMIL CC(=O)C1=CC=CC=C1
IUPAC navn 1-phenylethanon
InChI nøgle KWOLFJPFCHCOCG-UHFFFAOYSA-N
6
Kampagner er tilgængelige

Benzil, 99+%

CAS: 134-81-6 Molekylær formel: C14H10O2 Molekylvægt (g/mol): 210.23 MDL nummer: MFCD00003080 InChI nøgle: WURBFLDFSFBTLW-UHFFFAOYSA-N Synonym: benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon PubChem CID: 8651 ChEBI: CHEBI:51507 IUPAC navn: 1,2-diphenylethan-1,2-dion SMIL: O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

EDGE
MDL nummer MFCD00003080
PubChem CID 8651
Molekylvægt (g/mol) 210.23
CAS 134-81-6
ChEBI CHEBI:51507
Synonym benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon
SMIL O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC navn 1,2-diphenylethan-1,2-dion
InChI nøgle WURBFLDFSFBTLW-UHFFFAOYSA-N
Molekylær formel C14H10O2
7

3-Chloro-2,4-pentanedione, 98%

CAS: 1694-29-7 Molekylær formel: C5H7ClO2 Molekylvægt (g/mol): 134.56 MDL nummer: MFCD00009651 InChI nøgle: VLRGXXKFHVJQOL-UHFFFAOYSA-N PubChem CID: 74328 IUPAC navn: 3-chlorpentan-2,4-dion SMIL: CC(=O)C(C(=O)C)Cl

MDL nummer MFCD00009651
PubChem CID 74328
Molekylvægt (g/mol) 134.56
CAS 1694-29-7
SMIL CC(=O)C(C(=O)C)Cl
IUPAC navn 3-chlorpentan-2,4-dion
InChI nøgle VLRGXXKFHVJQOL-UHFFFAOYSA-N
Molekylær formel C5H7ClO2
8

3,5-diiodosalicylaldehyd, 97 %, Thermo Scientific Chemicals

CAS: 2631-77-8 Molekylær formel: C7H4I2O2 Molekylvægt (g/mol): 373.92 InChI nøgle: MYWSBJKVOUZCIA-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo PubChem CID: 75829 IUPAC navn: 2-hydroxy-3,5-diiodbenzaldehyd SMIL: C1=C(C=C(C(=C1I)O)C=O)I

PubChem CID 75829
Molekylvægt (g/mol) 373.92
CAS 2631-77-8
Synonym 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo
SMIL C1=C(C=C(C(=C1I)O)C=O)I
IUPAC navn 2-hydroxy-3,5-diiodbenzaldehyd
InChI nøgle MYWSBJKVOUZCIA-UHFFFAOYSA-N
Molekylær formel C7H4I2O2
9
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Acetaldehyde, 99.5%, extra pure, AcroSeal™

CAS: 75-07-0 Molekylær formel: C2H4O Molekylvægt (g/mol): 44.04 MDL nummer: MFCD00006991 InChI nøgle: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC navn: acetaldehyd SMIL: CC=O

MDL nummer MFCD00006991
PubChem CID 177
Molekylvægt (g/mol) 44.04
CAS 75-07-0
ChEBI CHEBI:15343
Synonym ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique
SMIL CC=O
IUPAC navn acetaldehyd
InChI nøgle IKHGUXGNUITLKF-UHFFFAOYSA-N
Molekylær formel C2H4O
10

Butyroin, 97 %, Thermo Scientific Chemicals

CAS: 496-77-5 Molekylær formel: C8H16O2 Molekylvægt (g/mol): 144.21 MDL nummer: MFCD00021928 InChI nøgle: BVEYJWQCMOVMAR-UHFFFAOYNA-N Synonym: butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone PubChem CID: 219794 IUPAC navn: 5-hydroxyoctan-4-on SMIL: CCCC(O)C(=O)CCC

MDL nummer MFCD00021928
PubChem CID 219794
Molekylvægt (g/mol) 144.21
CAS 496-77-5
Synonym butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone
SMIL CCCC(O)C(=O)CCC
IUPAC navn 5-hydroxyoctan-4-on
InChI nøgle BVEYJWQCMOVMAR-UHFFFAOYNA-N
Molekylær formel C8H16O2
11

3-Butyn-2-one, 96%

CAS: 1423-60-5 Molekylær formel: C4H4O Molekylvægt (g/mol): 68.08 MDL nummer: MFCD00008775 InChI nøgle: XRGPFNGLRSIPSA-UHFFFAOYSA-N Synonym: 3-butyn-2-one,1-butyn-3-one,methyl ethynyl ketone,acetylacetylene,butyn-2-one,acetylethyne,1-butyne-3-one,3-butyne-2-one,ethynyl methyl ketone,ch3coc#ch PubChem CID: 15018 ChEBI: CHEBI:48060 IUPAC navn: men-3-yn-2-en SMIL: CC(=O)C#C

MDL nummer MFCD00008775
PubChem CID 15018
Molekylvægt (g/mol) 68.08
CAS 1423-60-5
ChEBI CHEBI:48060
Synonym 3-butyn-2-one,1-butyn-3-one,methyl ethynyl ketone,acetylacetylene,butyn-2-one,acetylethyne,1-butyne-3-one,3-butyne-2-one,ethynyl methyl ketone,ch3coc#ch
SMIL CC(=O)C#C
IUPAC navn men-3-yn-2-en
InChI nøgle XRGPFNGLRSIPSA-UHFFFAOYSA-N
Molekylær formel C4H4O
12
Kampagner er tilgængelige

5-(Hydroxymethyl)furfural, 98%

CAS: 67-47-0 Molekylær formel: C6H6O3 Molekylvægt (g/mol): 126.11 InChI nøgle: NOEGNKMFWQHSLB-UHFFFAOYSA-N Synonym: 5-hydroxymethylfurfural,5-hydroxymethyl-2-furaldehyde,5-hydroxymethyl furfural,5-hydroxymethyl furan-2-carbaldehyde,hydroxymethylfurfural,5-hydroxymethyl-2-furfural,5-oxymethylfurfurole,5-hydroxymethylfuraldehyde,hydroxymethylfurfurole PubChem CID: 237332 ChEBI: CHEBI:412516 IUPAC navn: 5-(hydroxymethyl)furan-2-carbaldehyd SMIL: C1=C(OC(=C1)C=O)CO

PubChem CID 237332
Molekylvægt (g/mol) 126.11
CAS 67-47-0
ChEBI CHEBI:412516
Synonym 5-hydroxymethylfurfural,5-hydroxymethyl-2-furaldehyde,5-hydroxymethyl furfural,5-hydroxymethyl furan-2-carbaldehyde,hydroxymethylfurfural,5-hydroxymethyl-2-furfural,5-oxymethylfurfurole,5-hydroxymethylfuraldehyde,hydroxymethylfurfurole
SMIL C1=C(OC(=C1)C=O)CO
IUPAC navn 5-(hydroxymethyl)furan-2-carbaldehyd
InChI nøgle NOEGNKMFWQHSLB-UHFFFAOYSA-N
Molekylær formel C6H6O3
13

5-Allyl-2-hydroxy-3-methoxybenzaldehyde, 98%

CAS: 22934-51-6 Molekylær formel: C11H12O3 Molekylvægt (g/mol): 192.21 MDL nummer: MFCD06408022 InChI nøgle: FDHXEIOBIOVBEN-UHFFFAOYSA-N Synonym: 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde PubChem CID: 1713887 IUPAC navn: 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyd SMIL: COC1=C(C(=CC(=C1)CC=C)C=O)O

MDL nummer MFCD06408022
PubChem CID 1713887
Molekylvægt (g/mol) 192.21
CAS 22934-51-6
Synonym 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde
SMIL COC1=C(C(=CC(=C1)CC=C)C=O)O
IUPAC navn 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyd
InChI nøgle FDHXEIOBIOVBEN-UHFFFAOYSA-N
Molekylær formel C11H12O3
14

3,4-dibenzyloxybenzaldehyd, 99 %, Thermo Scientific Chemicals

CAS: 5447-02-9 Molekylær formel: C21H18O3 Molekylvægt (g/mol): 318.36 MDL nummer: MFCD00004776 InChI nøgle: XDDLXZHBWVFPRG-UHFFFAOYSA-N Synonym: 3,4-dibenzyloxybenzaldehyde,3,4-bis benzyloxy benzaldehyde,3,4-dibenzyloxy benzaldehyde,3,4-bis phenylmethoxy benzaldehyde,xddlxzhbwvfprg-uhfffaoysa-n,3.4-dibenzyloxybenzaldehyde,3,4-dibenzyloxy-benzaldehyde,3,4-dibenzyl-oxybenzaldehyde,benzaldehyde, 3,4-dibenzyloxy,xddlxzhbwvfprg-uhfffaoysa PubChem CID: 79526

MDL nummer MFCD00004776
PubChem CID 79526
Molekylvægt (g/mol) 318.36
CAS 5447-02-9
Synonym 3,4-dibenzyloxybenzaldehyde,3,4-bis benzyloxy benzaldehyde,3,4-dibenzyloxy benzaldehyde,3,4-bis phenylmethoxy benzaldehyde,xddlxzhbwvfprg-uhfffaoysa-n,3.4-dibenzyloxybenzaldehyde,3,4-dibenzyloxy-benzaldehyde,3,4-dibenzyl-oxybenzaldehyde,benzaldehyde, 3,4-dibenzyloxy,xddlxzhbwvfprg-uhfffaoysa
InChI nøgle XDDLXZHBWVFPRG-UHFFFAOYSA-N
Molekylær formel C21H18O3
15
Kampagner er tilgængelige

2,4-Dihydroxybenzaldehyde, 98%

CAS: 95-01-2 Molekylær formel: C7H6O3 Molekylvægt (g/mol): 138.12 MDL nummer: MFCD00011686 InChI nøgle: IUNJCFABHJZSKB-UHFFFAOYSA-N Synonym: beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde PubChem CID: 7213 ChEBI: CHEBI:50198 IUPAC navn: 2,4-dihydroxybenzaldehyd SMIL: OC1=CC=C(C=O)C(O)=C1

MDL nummer MFCD00011686
PubChem CID 7213
Molekylvægt (g/mol) 138.12
CAS 95-01-2
ChEBI CHEBI:50198
Synonym beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde
SMIL OC1=CC=C(C=O)C(O)=C1
IUPAC navn 2,4-dihydroxybenzaldehyd
InChI nøgle IUNJCFABHJZSKB-UHFFFAOYSA-N
Molekylær formel C7H6O3