3-(5-Nitropyridin-2-yl)benzoic acid

Modify Date: 2025-09-18 16:07:10

3-(5-Nitropyridin-2-yl)benzoic acid Structure
3-(5-Nitropyridin-2-yl)benzoic acid structure
Common Name 3-(5-Nitropyridin-2-yl)benzoic acid
CAS Number 864075-95-6 Molecular Weight 244.20300
Density 1.417 g/cm3 Boiling Point 477.3ºC at 760 mmHg
Molecular Formula C12H8N2O4 Melting Point N/A
MSDS N/A Flash Point 242.4ºC

 Names

Name 3-(5-Nitropyridin-2-yl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.417 g/cm3
Boiling Point 477.3ºC at 760 mmHg
Molecular Formula C12H8N2O4
Molecular Weight 244.20300
Flash Point 242.4ºC
Exact Mass 244.04800
PSA 96.01000
LogP 2.87820
Index of Refraction 1.644
InChIKey NLHLQKGYMCYSQS-UHFFFAOYSA-N
SMILES O=C(O)c1cccc(-c2ccc([N+](=O)[O-])cn2)c1

 Safety Information

Hazard Codes Xi
HS Code 2933399090

 Synthetic Route

~88%

3-(5-Nitropyridin-2-yl)benzoic acid Structure

3-(5-Nitropyrid...

CAS#:864075-95-6

Literature: SPIROGEN LIMITED Patent: WO2005/85177 A2, 2005 ; Location in patent: Page/Page column 50-51 ;

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933399090
Summary 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

3-(5-nitropyridin-2-yl)benzoic acid
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