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Barbitursyre

Barbitursyre er moderforbindelsen til barbituratlægemidler; en organisk syre baseret på et heterocyklisk pyrimidinskelet. Forbindelsen kan bruges i Knoevenagel-kondensationsreaktionen til at syntetisere en række stoffer, der deprimerer centralnervesystemet.

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1

5,5-Dibromobarbituric acid, 95+%

CAS: 511-67-1 Molekylær formel: C4H2Br2N2O3 Molekylvægt (g/mol): 285.88 MDL nummer: MFCD00010595 InChI nøgle: AMATXUCYHHHHHB-UHFFFAOYSA-N Synonym: 5,5-dibromobarbituric acid,dibromin,5,5-dibromopyrimidine-2,4,6 1h,3h,5h-trione,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dibromo,dibrombarbitursaure,dibromobarbituric acid,acmc-20am7j,barbituric acid,5-dibromo,diethyl trimethylsilylphosphate PubChem CID: 94877 IUPAC navn: 5,5-dibrom-1,3-diazinan-2,4,6-trion SMIL: BrC1(Br)C(=O)NC(=O)NC1=O

MDL nummer MFCD00010595
PubChem CID 94877
Molekylvægt (g/mol) 285.88
CAS 511-67-1
Synonym 5,5-dibromobarbituric acid,dibromin,5,5-dibromopyrimidine-2,4,6 1h,3h,5h-trione,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dibromo,dibrombarbitursaure,dibromobarbituric acid,acmc-20am7j,barbituric acid,5-dibromo,diethyl trimethylsilylphosphate
SMIL BrC1(Br)C(=O)NC(=O)NC1=O
IUPAC navn 5,5-dibrom-1,3-diazinan-2,4,6-trion
InChI nøgle AMATXUCYHHHHHB-UHFFFAOYSA-N
Molekylær formel C4H2Br2N2O3
2
Kampagner er tilgængelige

Barbitursyre, 99+%, Thermo Scientific Chemicals

CAS: 67-52-7 Molekylær formel: C4H4N2O3 Molekylvægt (g/mol): 128.09 MDL nummer: MFCD00006666 InChI nøgle: HNYOPLTXPVRDBG-UHFFFAOYSA-N Synonym: barbituric acid,malonylurea,2,4,6 1h,3h,5h-pyrimidinetrione,6-hydroxyuracil,pyrimidinetrione,2,4,6-trihydroxypyrimidine,2,4,6-pyrimidinetrione,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,malonylharnstoff PubChem CID: 6211 ChEBI: CHEBI:16294 IUPAC navn: 1,3-diazinan-2,4,6-trion SMIL: O=C1CC(=O)NC(=O)N1

MDL nummer MFCD00006666
PubChem CID 6211
Molekylvægt (g/mol) 128.09
CAS 67-52-7
ChEBI CHEBI:16294
Synonym barbituric acid,malonylurea,2,4,6 1h,3h,5h-pyrimidinetrione,6-hydroxyuracil,pyrimidinetrione,2,4,6-trihydroxypyrimidine,2,4,6-pyrimidinetrione,pyrimidine-2,4,6 1h,3h,5h-trione,barbiturate,malonylharnstoff
SMIL O=C1CC(=O)NC(=O)N1
IUPAC navn 1,3-diazinan-2,4,6-trion
InChI nøgle HNYOPLTXPVRDBG-UHFFFAOYSA-N
Molekylær formel C4H4N2O3
3

1,3-dimethylbarbitursyre, 99 % (tørvægt), vand< 6 %, Thermo Scientific Chemicals

CAS: 769-42-6 Molekylær formel: C6H8N2O3 Molekylvægt (g/mol): 156.141 MDL nummer: MFCD00006675 InChI nøgle: VVSASNKOFCZVES-UHFFFAOYSA-N Synonym: 1,3-dimethylbarbituric acid,n,n'-dimethylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 1,3-dimethyl,1,3-dimethylbarbituricacid,barbituric acid, 1,3-dimethyl,1,3-dimethylpyrimidine-2,4,6 1h,3h,5h-trione,1,3-dimethyl barbituric acid,1,3-dimethyl-2,4,6 1h,3h,5h-pyrimidinetrione,1,3-dimethyl-2,4,6 1h,3h,5h pyrimidinetrione,1,3-dimethyl-1,3,5-trihydropyrimidine-2,4,6-trione PubChem CID: 69860 IUPAC navn: 1,3-dimethyl-1,3-diazinan-2,4,6-trion SMIL: CN1C(=O)CC(=O)N(C1=O)C

MDL nummer MFCD00006675
PubChem CID 69860
Molekylvægt (g/mol) 156.141
CAS 769-42-6
Synonym 1,3-dimethylbarbituric acid,n,n'-dimethylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 1,3-dimethyl,1,3-dimethylbarbituricacid,barbituric acid, 1,3-dimethyl,1,3-dimethylpyrimidine-2,4,6 1h,3h,5h-trione,1,3-dimethyl barbituric acid,1,3-dimethyl-2,4,6 1h,3h,5h-pyrimidinetrione,1,3-dimethyl-2,4,6 1h,3h,5h pyrimidinetrione,1,3-dimethyl-1,3,5-trihydropyrimidine-2,4,6-trione
SMIL CN1C(=O)CC(=O)N(C1=O)C
IUPAC navn 1,3-dimethyl-1,3-diazinan-2,4,6-trion
InChI nøgle VVSASNKOFCZVES-UHFFFAOYSA-N
Molekylær formel C6H8N2O3
5

Murexide

CAS: 3051-09-0 Molekylær formel: C8H3N5O6-2 Molekylvægt (g/mol): 265.141 MDL nummer: MFCD00012777 InChI nøgle: MUMMBXDKKJEASE-UHFFFAOYSA-L Synonym: murexide,ammonium purpurate acid,6-oxo-5-2,4,6-trioxo-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate,5-hexahydro-2,4,6-trioxo-5-pyrimidinyl imino-2,4,6 1h,3h,5h-pyrimidinetrione ammonium salt,6-oxidanylidene-5-2,4,6-tris oxidanylidene-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate PubChem CID: 51381221 IUPAC navn: 6-oxo-5-[(2,4,6-trioxo-1,3-diazinan-5-yliden)amino]-1H-pyrimidin-2,4-diolat SMIL: C1(=C(N=C(NC1=O)[O-])[O-])N=C2C(=O)NC(=O)NC2=O

EDGE
MDL nummer MFCD00012777
PubChem CID 51381221
Molekylvægt (g/mol) 265.141
CAS 3051-09-0
Synonym murexide,ammonium purpurate acid,6-oxo-5-2,4,6-trioxo-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate,5-hexahydro-2,4,6-trioxo-5-pyrimidinyl imino-2,4,6 1h,3h,5h-pyrimidinetrione ammonium salt,6-oxidanylidene-5-2,4,6-tris oxidanylidene-1,3-diazinan-5-ylidene amino-1h-pyrimidine-2,4-diolate
SMIL C1(=C(N=C(NC1=O)[O-])[O-])N=C2C(=O)NC(=O)NC2=O
IUPAC navn 6-oxo-5-[(2,4,6-trioxo-1,3-diazinan-5-yliden)amino]-1H-pyrimidin-2,4-diolat
InChI nøgle MUMMBXDKKJEASE-UHFFFAOYSA-L
Molekylær formel C8H3N5O6-2
6

Alloxan monohydrat, 98%, Thermo Scientific Chemicals

CAS: 3237-50-1 Molekylær formel: C4H4N2O5 Molekylvægt (g/mol): 160.085 MDL nummer: MFCD00149399 InChI nøgle: ZIIHZVKHFWOENY-UHFFFAOYSA-N Synonym: barbituric acid, 5,5-dihydroxy,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dihydroxy,unii-o2aap9f8b6,5,5-dihydroxybarbituric acid,ccris 5957,mesoxalylurea monohydrate,2,4,5,6 1h,3h-pyrimidinetetrone hydrate,5,5-dihydroxyperhydropyrimidinetrione,5,5-dihydroxy-2,4,6 1h,3h,5h-pyrimidinetrione,o2aap9f8b6 PubChem CID: 312231 IUPAC navn: 5,5-dihydroxy-1,3-diazinan-2,4,6-trion SMIL: C1(=O)C(C(=O)NC(=O)N1)(O)O

MDL nummer MFCD00149399
PubChem CID 312231
Molekylvægt (g/mol) 160.085
CAS 3237-50-1
Synonym barbituric acid, 5,5-dihydroxy,2,4,6 1h,3h,5h-pyrimidinetrione, 5,5-dihydroxy,unii-o2aap9f8b6,5,5-dihydroxybarbituric acid,ccris 5957,mesoxalylurea monohydrate,2,4,5,6 1h,3h-pyrimidinetetrone hydrate,5,5-dihydroxyperhydropyrimidinetrione,5,5-dihydroxy-2,4,6 1h,3h,5h-pyrimidinetrione,o2aap9f8b6
SMIL C1(=O)C(C(=O)NC(=O)N1)(O)O
IUPAC navn 5,5-dihydroxy-1,3-diazinan-2,4,6-trion
InChI nøgle ZIIHZVKHFWOENY-UHFFFAOYSA-N
Molekylær formel C4H4N2O5
7

(1R)-endo-(+)-Fenchyl alcohol, 96%

CAS: 2217-02-9 MDL nummer: MFCD00003760

MDL nummer MFCD00003760
CAS 2217-02-9
8

Alloxan monohydrat, 98%, Thermo Scientific Chemicals

CAS: 3237-50-1 Molekylær formel: C4H4N2O5 MDL nummer: MFCD00149399 InChI nøgle: ZIIHZVKHFWOENY-UHFFFAOYSA-N

MDL nummer MFCD00149399
CAS 3237-50-1
InChI nøgle ZIIHZVKHFWOENY-UHFFFAOYSA-N
Molekylær formel C4H4N2O5
9

Isopropylbarbituric acid, 97%, Thermo Scientific™

CAS: 7391-69-7 Molekylær formel: C7H10N2O3 Molekylvægt (g/mol): 170.168 InChI nøgle: GFPIGNBQTXNNAG-UHFFFAOYSA-N Synonym: 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione PubChem CID: 81874 IUPAC navn: 5-propan-2-yl-1,3-diazinane-2,4,6-trione SMIL: CC(C)C1C(=O)NC(=O)NC1=O

PubChem CID 81874
Molekylvægt (g/mol) 170.168
CAS 7391-69-7
Synonym 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione
SMIL CC(C)C1C(=O)NC(=O)NC1=O
IUPAC navn 5-propan-2-yl-1,3-diazinane-2,4,6-trione
InChI nøgle GFPIGNBQTXNNAG-UHFFFAOYSA-N
Molekylær formel C7H10N2O3
10

5-Isopropylbarbituric acid, 98%, Thermo Scientific™

CAS: 7391-69-7 Molekylær formel: C7H10N2O3 Molekylvægt (g/mol): 170.168 MDL nummer: MFCD00051832 InChI nøgle: GFPIGNBQTXNNAG-UHFFFAOYSA-N Synonym: 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione PubChem CID: 81874 IUPAC navn: 5-propan-2-yl-1,3-diazinane-2,4,6-trione SMIL: CC(C)C1C(=O)NC(=O)NC1=O

MDL nummer MFCD00051832
PubChem CID 81874
Molekylvægt (g/mol) 170.168
CAS 7391-69-7
Synonym 5-isopropylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-isopropylpyrimidine-2,4,6 1h,3h,5h-trione,5-isopropyl barbituric acid,barbituric acid, 5-isopropyl,barbituric acid, 5-ipr,2,6 1h,3h,5h-pyrimidinetrione, 5-1-methylethyl,5-1-methylethyl pyrimidine-2,4,6 1h,3h,5h-trione
SMIL CC(C)C1C(=O)NC(=O)NC1=O
IUPAC navn 5-propan-2-yl-1,3-diazinane-2,4,6-trione
InChI nøgle GFPIGNBQTXNNAG-UHFFFAOYSA-N
Molekylær formel C7H10N2O3
11

1-Benzyl-5-phenylbarbitursyre, 98+%, Thermo Scientific Chemicals

CAS: 72846-00-5 Molekylær formel: C17H14N2O3 Molekylvægt (g/mol): 294.31 MDL nummer: MFCD00082750 InChI nøgle: KCWWCWMGJOWTMY-UHFFFAOYNA-N Synonym: 1-benzyl-5-phenylbarbituric acid,1-benzyl-5-phenylpyrimidine-2,4,6 1h,3h,5h-trione,benzyl-5-phenylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-phenyl-1-phenylmethyl,1-phenylmethyl-5-phenyl-barbituric acid,5-phenyl-1-benzyl-1,3,5-trihydropyrimidine-2,4,6-trione,acmc-1bb85,1-benzyl-5-phenylbarbiturate,1-benzyl-5-phenylbarbituricacid,1-benzyl-5-phenylbarbituric acid 5g PubChem CID: 166340 IUPAC navn: 1-benzyl-5-phenyl-1,3-diazinan-2,4,6-trion SMIL: O=C1NC(=O)N(CC2=CC=CC=C2)C(=O)C1C1=CC=CC=C1

MDL nummer MFCD00082750
PubChem CID 166340
Molekylvægt (g/mol) 294.31
CAS 72846-00-5
Synonym 1-benzyl-5-phenylbarbituric acid,1-benzyl-5-phenylpyrimidine-2,4,6 1h,3h,5h-trione,benzyl-5-phenylbarbituric acid,2,4,6 1h,3h,5h-pyrimidinetrione, 5-phenyl-1-phenylmethyl,1-phenylmethyl-5-phenyl-barbituric acid,5-phenyl-1-benzyl-1,3,5-trihydropyrimidine-2,4,6-trione,acmc-1bb85,1-benzyl-5-phenylbarbiturate,1-benzyl-5-phenylbarbituricacid,1-benzyl-5-phenylbarbituric acid 5g
SMIL O=C1NC(=O)N(CC2=CC=CC=C2)C(=O)C1C1=CC=CC=C1
IUPAC navn 1-benzyl-5-phenyl-1,3-diazinan-2,4,6-trion
InChI nøgle KCWWCWMGJOWTMY-UHFFFAOYNA-N
Molekylær formel C17H14N2O3