2-Acetylaminoisonicotinic acid

Modify Date: 2025-08-25 23:07:09

2-Acetylaminoisonicotinic acid Structure
2-Acetylaminoisonicotinic acid structure
Common Name 2-Acetylaminoisonicotinic acid
CAS Number 54221-95-3 Molecular Weight 180.16100
Density 1.404g/cm3 Boiling Point 585.3ºC at 760mmHg
Molecular Formula C8H8N2O3 Melting Point 286-290ºC
MSDS Chinese USA Flash Point 307.8ºC

 Names

Name 2-Acetylaminoisonicotinic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.404g/cm3
Boiling Point 585.3ºC at 760mmHg
Melting Point 286-290ºC
Molecular Formula C8H8N2O3
Molecular Weight 180.16100
Flash Point 307.8ºC
Exact Mass 180.05300
PSA 79.29000
LogP 0.81120
Index of Refraction 1.628
InChIKey VNQIEKXUBYBTPS-UHFFFAOYSA-N
SMILES CC(=O)Nc1cc(C(=O)O)ccn1

 Safety Information

Hazard Codes Xi
RIDADR NONH for all modes of transport
HS Code 2933399090

 Synthetic Route

~42%

2-Acetylaminoisonicotinic acid Structure

2-Acetylaminois...

CAS#:54221-95-3

Literature: MERCKLE GMBH Patent: EP1894925 A1, 2008 ; Location in patent: Page/Page column 14; 41 ;

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2-Acetylaminoisonicotinic acid Structure

2-Acetylaminois...

CAS#:54221-95-3

Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 16, # 23 p. 5978 - 5981

 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

2-acetamidopyridine-4-carboxylic acid
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