2-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid

Modify Date: 2025-11-24 10:54:53

2-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid Structure
2-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid structure
Common Name 2-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid
CAS Number 33522-81-5 Molecular Weight 262.69200
Density 1.402g/cm3 Boiling Point 452.6ºC at 760 mmHg
Molecular Formula C13H11ClN2O2 Melting Point N/A
MSDS N/A Flash Point 227.5ºC

 Names

Name 2-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.402g/cm3
Boiling Point 452.6ºC at 760 mmHg
Molecular Formula C13H11ClN2O2
Molecular Weight 262.69200
Flash Point 227.5ºC
Exact Mass 262.05100
PSA 62.22000
LogP 3.11830
Index of Refraction 1.673
InChIKey DOLGQLPAEFRJLV-UHFFFAOYSA-N
SMILES O=C(O)c1cccnc1NCc1ccc(Cl)cc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QT0880000
CHEMICAL NAME :
Nicotinic acid, 2-(p-chlorobenzylamino)-
CAS REGISTRY NUMBER :
33522-81-5
BEILSTEIN REFERENCE NO. :
0410392
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H11-Cl-N2-O2
MOLECULAR WEIGHT :
262.71
WISWESSER LINE NOTATION :
T6NJ BM1R DG& CVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
62500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 4,46,1952

 Safety Information

HS Code 2933399090

 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

s 217
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