Nitrobenzoesyrer og derivater

Organiske forbindelser, der består af benzoesyre med en nitrogruppesubstitution; en nitrogruppe har et nitrogenatom bundet til to oxygengrupper i en enkelt- og en dobbeltbinding. Omfatter forbindelser, der er direkte afledt af nitrobenzoesyre.

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Methyl 3-nitrobenzoat, 98%

CAS: 618-95-1 Molekylær formel: C₈H₇NO₄ Molekylvægt (g/mol): 181.15 MDL nummer: MFCD00007250 InChI nøgle: AXLYJLKKPUICKV-UHFFFAOYSA-N Synonym: 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate PubChem CID: 69260 IUPAC navn: methyl-3-nitrobenzoat SMIL: COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007250
PubChem CID	69260
Molekylvægt (g/mol)	181.15
CAS	618-95-1
Synonym	3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate
SMIL	COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
IUPAC navn	methyl-3-nitrobenzoat
InChI nøgle	AXLYJLKKPUICKV-UHFFFAOYSA-N
Molekylær formel	C₈H₇NO₄

4-Nitrobenzoesyre, 99+%

CAS: 62-23-7 Molekylær formel: C₇H₅NO₄ Molekylvægt (g/mol): 167.12 MDL nummer: MFCD00007352 InChI nøgle: OTLNPYWUJOZPPA-UHFFFAOYSA-N Synonym: 4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova PubChem CID: 6108 ChEBI: CHEBI:262350 SMIL: C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007352
PubChem CID	6108
Molekylvægt (g/mol)	167.12
CAS	62-23-7
ChEBI	CHEBI:262350
Synonym	4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova
SMIL	C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]
InChI nøgle	OTLNPYWUJOZPPA-UHFFFAOYSA-N
Molekylær formel	C₇H₅NO₄

5,5'-Dithiobis (2-nitrobenzoesyre), 99%

CAS: 69-78-3 Molekylær formel: C14H8N2O8S2 Molekylvægt (g/mol): 396.34 MDL nummer: MFCD00007140 InChI nøgle: KIUMMUBSPKGMOY-UHFFFAOYSA-N Synonym: dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid PubChem CID: 6254 ChEBI: CHEBI:86228 IUPAC navn: 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoesyre SMIL: OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007140
PubChem CID	6254
Molekylvægt (g/mol)	396.34
CAS	69-78-3
ChEBI	CHEBI:86228
Synonym	dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid
SMIL	OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O
IUPAC navn	5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoesyre
InChI nøgle	KIUMMUBSPKGMOY-UHFFFAOYSA-N
Molekylær formel	C14H8N2O8S2

MDL nummer	MFCD00007140
PubChem CID	6254
Molekylvægt (g/mol)	396.34
CAS	69-78-3
ChEBI	CHEBI:86228
Synonym	dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid
SMIL	OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O
IUPAC navn	5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoesyre
InChI nøgle	KIUMMUBSPKGMOY-UHFFFAOYSA-N
Molekylær formel	C14H8N2O8S2

4-Nitrobenzoesyre, 99%

CAS: 62-23-7 Molekylær formel: C7H5NO4 Molekylvægt (g/mol): 167.12 MDL nummer: MFCD00007352 InChI nøgle: OTLNPYWUJOZPPA-UHFFFAOYSA-N Synonym: 4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova PubChem CID: 6108 ChEBI: CHEBI:262350 SMIL: C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007352
PubChem CID	6108
Molekylvægt (g/mol)	167.12
CAS	62-23-7
ChEBI	CHEBI:262350
Synonym	4-nitrobenzoic acid,p-nitrobenzoic acid,benzoic acid, 4-nitro,nitrodracylic acid,4-nitrodracylic acid,1-carboxy-4-nitrobenzene,benzoic acid, p-nitro,p-nitrobenzoicacid,p-nitrobenzenecarboxylic acid,kyselina p-nitrobenzoova
SMIL	C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]
InChI nøgle	OTLNPYWUJOZPPA-UHFFFAOYSA-N
Molekylær formel	C7H5NO4

3-Methyl-4-nitrobenzoesyre, 99%

CAS: 3113-71-1 Molekylær formel: C₈H₇NO₄ Molekylvægt (g/mol): 181.15 MDL nummer: MFCD00007168 InChI nøgle: XDTTUTIFWDAMIX-UHFFFAOYSA-N PubChem CID: 18370 SMIL: CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007168
PubChem CID	18370
Molekylvægt (g/mol)	181.15
CAS	3113-71-1
SMIL	CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]
InChI nøgle	XDTTUTIFWDAMIX-UHFFFAOYSA-N
Molekylær formel	C₈H₇NO₄

2-nitrobenzoesyre, 95%

CAS: 552-16-9 Molekylær formel: C7H5NO4 Molekylvægt (g/mol): 167.12 MDL nummer: MFCD00007137 InChI nøgle: SLAMLWHELXOEJZ-UHFFFAOYSA-N Synonym: 2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid PubChem CID: 11087 ChEBI: CHEBI:25620 SMIL: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007137
PubChem CID	11087
Molekylvægt (g/mol)	167.12
CAS	552-16-9
ChEBI	CHEBI:25620
Synonym	2-nitrobenzoic acid,o-nitrobenzoic acid,benzoic acid, 2-nitro,2-nitrobenzoicacid,o-carboxynitrobenzene,benzoic acid, o-nitro,nitrobenzoic acid,2-nitro-benzoic acid,ccris 2334,2-nitro benzoic acid
SMIL	C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
InChI nøgle	SLAMLWHELXOEJZ-UHFFFAOYSA-N
Molekylær formel	C7H5NO4

4-Methyl-3-nitrobenzoesyre, 99%

CAS: 96-98-0 Molekylær formel: C₈H₇NO₄ Molekylvægt (g/mol): 181.15 MDL nummer: MFCD00007174 InChI nøgle: BBEWSMNRCUXQRF-UHFFFAOYSA-N PubChem CID: 7319 SMIL: CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007174
PubChem CID	7319
Molekylvægt (g/mol)	181.15
CAS	96-98-0
SMIL	CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]
InChI nøgle	BBEWSMNRCUXQRF-UHFFFAOYSA-N
Molekylær formel	C₈H₇NO₄

3-Methyl-2-nitrobenzoesyre, 98%

CAS: 5437-38-7 Molekylær formel: C8H7NO4 Molekylvægt (g/mol): 181.15 MDL nummer: MFCD00007180 InChI nøgle: DGDAVTPQCQXLGU-UHFFFAOYSA-N Synonym: 3-methyl-2-nitrobenzoic acid,2-nitro-m-toluic acid,2-nitro-3-methylbenzoic acid,benzoic acid, 3-methyl-2-nitro,unii-61wop984ab,3-methyl-2-nitro-benzoic acid,3-methyl-2-nitrobenzoicacid,pubchem8352,acmc-1ashh,dsstox_cid_5640 PubChem CID: 21575 IUPAC navn: 3-methyl-2-nitrobenzoesyre SMIL: CC1=CC=CC(C(O)=O)=C1[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007180
PubChem CID	21575
Molekylvægt (g/mol)	181.15
CAS	5437-38-7
Synonym	3-methyl-2-nitrobenzoic acid,2-nitro-m-toluic acid,2-nitro-3-methylbenzoic acid,benzoic acid, 3-methyl-2-nitro,unii-61wop984ab,3-methyl-2-nitro-benzoic acid,3-methyl-2-nitrobenzoicacid,pubchem8352,acmc-1ashh,dsstox_cid_5640
SMIL	CC1=CC=CC(C(O)=O)=C1[N+]([O-])=O
IUPAC navn	3-methyl-2-nitrobenzoesyre
InChI nøgle	DGDAVTPQCQXLGU-UHFFFAOYSA-N
Molekylær formel	C8H7NO4

2-Hydroxy-4-nitrobenzoesyre, 97 %, Thermo Scientific Chemicals

Pris og tilgængelighed

2-amino-5-nitrobenzoesyre, 98%

CAS: 616-79-5 Molekylær formel: C7H6N2O4 Molekylvægt (g/mol): 182.14 MDL nummer: MFCD00017039 InChI nøgle: RUCHWTKMOWXHLU-UHFFFAOYSA-N Synonym: 5-nitroanthranilic acid,benzoic acid, 2-amino-5-nitro,2-amino-5-nitro-benzoic acid,2-amino-5-nitrobenzoicacid,anthranilic acid, 5-nitro,1-amino-2-carboxy-4-nitrobenzene,2-amino-5-nitro-benzoicacid,pubchem14422,acmc-209mvd,5-nitro anthranilic acid PubChem CID: 12032 ChEBI: CHEBI:61280 IUPAC navn: 2-amino-5-nitrobenzoesyre SMIL: NC1=CC=C(C=C1C(O)=O)[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00017039
PubChem CID	12032
Molekylvægt (g/mol)	182.14
CAS	616-79-5
ChEBI	CHEBI:61280
Synonym	5-nitroanthranilic acid,benzoic acid, 2-amino-5-nitro,2-amino-5-nitro-benzoic acid,2-amino-5-nitrobenzoicacid,anthranilic acid, 5-nitro,1-amino-2-carboxy-4-nitrobenzene,2-amino-5-nitro-benzoicacid,pubchem14422,acmc-209mvd,5-nitro anthranilic acid
SMIL	NC1=CC=C(C=C1C(O)=O)[N+]([O-])=O
IUPAC navn	2-amino-5-nitrobenzoesyre
InChI nøgle	RUCHWTKMOWXHLU-UHFFFAOYSA-N
Molekylær formel	C7H6N2O4

4-amino-3-nitrobenzoesyre, 98%, Thermo Scientific™

Pris og tilgængelighed

Natrium3-nitrobenzoat, 94%, kan indeholde op til ca. 10% vand

CAS: 827-95-2 Molekylær formel: C7H4NNaO4 Molekylvægt (g/mol): 189.10 MDL nummer: MFCD00150535,MFCD00051097 InChI nøgle: MUADFEZFSKAZLT-UHFFFAOYSA-M Synonym: sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733 PubChem CID: 70014 IUPAC navn: natrium;3-nitrobenzoat SMIL: [Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00150535,MFCD00051097
PubChem CID	70014
Molekylvægt (g/mol)	189.10
CAS	827-95-2
Synonym	sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733
SMIL	[Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O
IUPAC navn	natrium;3-nitrobenzoat
InChI nøgle	MUADFEZFSKAZLT-UHFFFAOYSA-M
Molekylær formel	C7H4NNaO4

Dimethyl 3-nitrofthalat, 98%

CAS: 13365-26-9 Molekylær formel: C10H9NO6 Molekylvægt (g/mol): 239.183 MDL nummer: MFCD00017184 InChI nøgle: MLQMIKSBTAZNBK-UHFFFAOYSA-N PubChem CID: 249912 IUPAC navn: dimethyl-3-nitrobenzen-1,2-dicarboxylat SMIL: COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00017184
PubChem CID	249912
Molekylvægt (g/mol)	239.183
CAS	13365-26-9
SMIL	COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC
IUPAC navn	dimethyl-3-nitrobenzen-1,2-dicarboxylat
InChI nøgle	MLQMIKSBTAZNBK-UHFFFAOYSA-N
Molekylær formel	C10H9NO6

Methyl 2-nitro-3,4,5-trimethoxybenzoat, 98%

CAS: 5081-42-5 Molekylær formel: C11H13NO7 Molekylvægt (g/mol): 271.225 MDL nummer: MFCD00007097 InChI nøgle: HCEIEWYPDCDNNU-UHFFFAOYSA-N Synonym: methyl 2-nitro-3,4,5-trimethoxybenzoate,methyl 6-nitro-3,4,5-trimethoxybenzoate,3,4,5-trimethoxy-2-nitrobenzoic acid methyl ester,benzoic acid, 3,4,5-trimethoxy-2-nitro-, methyl ester,2-nitro-3,4,5-trimethoxybenzoic acid methyl ester,pubchem22545,opera_id_1985,acmc-1ar8w,hceiewypdcdnnu-uhfffaoysa,methyl 3,5-trimethoxy-2-nitrobenzoate PubChem CID: 78765 IUPAC navn: methyl-3,4,5-trimethoxy-2-nitrobenzoat SMIL: COC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC

Pris og tilgængelighed
Tekniske data

MDL nummer	MFCD00007097
PubChem CID	78765
Molekylvægt (g/mol)	271.225
CAS	5081-42-5
Synonym	methyl 2-nitro-3,4,5-trimethoxybenzoate,methyl 6-nitro-3,4,5-trimethoxybenzoate,3,4,5-trimethoxy-2-nitrobenzoic acid methyl ester,benzoic acid, 3,4,5-trimethoxy-2-nitro-, methyl ester,2-nitro-3,4,5-trimethoxybenzoic acid methyl ester,pubchem22545,opera_id_1985,acmc-1ar8w,hceiewypdcdnnu-uhfffaoysa,methyl 3,5-trimethoxy-2-nitrobenzoate
SMIL	COC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC
IUPAC navn	methyl-3,4,5-trimethoxy-2-nitrobenzoat
InChI nøgle	HCEIEWYPDCDNNU-UHFFFAOYSA-N
Molekylær formel	C11H13NO7

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Nitrobenzoesyrer og derivater

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