2-(benzylamino)nicotinic acid

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Names

[ CAS No. ]:
33522-80-4

[ Name ]:
2-(benzylamino)nicotinic acid

[Synonym ]:
2-(Phenylmethylamino)Pyridine-3-Carboxylic Acid
3-pyridinecarboxylic acid, 2-[(phenylmethyl)amino]-
F2135-0897
2-(benzylamino)nicotinic acid
Nicotinic acid,2-(benzylamino)
S 216
2-(3-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXALDEHYDE
benzylaminonicotinicacid
2-[benzylamino]pyridine-3-carboxylic acid

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
426.3±35.0 °C at 760 mmHg

[ Molecular Formula ]:
C13H12N2O2

[ Molecular Weight ]:
228.247

[ Flash Point ]:
211.6±25.9 °C

[ Exact Mass ]:
228.089874

[ PSA ]:
62.22000

[ LogP ]:
3.22

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.668

[ Storage condition ]:
2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QT0840000
CHEMICAL NAME :
Nicotinic acid, 2-(benzylamino)-
CAS REGISTRY NUMBER :
33522-80-4
BEILSTEIN REFERENCE NO. :
0479775
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H12-N2-O2
MOLECULAR WEIGHT :
228.27
WISWESSER LINE NOTATION :
T6NJ BM1R& CVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
474 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 26,844,1971

Safety Information

[ Hazard Codes ]:
Xi

[ HS Code ]:
2933399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Chloronicotinic acid
  • Benzylamine

DownStream

  • 1-BENZYL-4-HYDROXY-1,8-NAPHTHYRIDIN-2(1H)-ONE
  • 1-BENZYL-1H-PYRIDO[2,3-D][1,3]OXAZINE-2,4-DIONE
  • 1-benzyl-4-phenyl-1,8-naphthyridin-2-one
  • 1-BENZYL-2-OXO-1,2-DIHYDRO-1,8-NAPHTHYRIDIN-4-YL ACETATE
  • 1-BENZYL-4-CHLORO-1,8-NAPHTHYRIDIN-2(1H)-ONE

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%

Related Compounds

  • 2-methoxy-6-(4-methoxy-benzylamino)-nicotinic acid methyl ester
  • 2-(3,4-difluorobenzylamino)nicotynic acid hydrazide
  • 2-(3,4-difluorobenzylamino)nicotinic acid ethyl ester
  • Thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 5-[(4-chlorophenyl)methylene]-2-phenyl-, (5E)-
  • (phenylthio-4-phenylamino)-2-nicotinic acid
  • 5-acetylamino-5-trimethylsilanylethynyl-2-nicotinic acid methyl ester
  • 4-Bromo-5-(difluoromethoxy)picolinonitrile
  • 4'-(Trifluoromethoxy)-5-(trifluoromethyl)-[1,1'-biphenyl]-3-sulfonyl chloride
  • 6-[(2-Ethoxyethyl)amino]-5-nitro-3-pyridinecarbonitrile
  • Tert-butyl 2-(((5-bromo-4-methylpyridin-2-yl)oxy)methyl)-2-ethylbutanoate
  • 3-(3-Chloro-4-fluorophenyl)pyrazin-2(1H)-one
  • (5-Bromopyridin-3-yl)(4-methylphenyl)methanol
  • 2-Thiopheneethanamine, N-[(4-chloro-3-nitrophenyl)methyl]-I+/--methyl-
  • (2R,6R)-4-benzyl-6-methylmorpholine-2-carbonitrile
  • 2-isopropoxypentan-1-amine
  • (2S)-2-[[(4-Chlorophenyl)sulfonyl]amino]-N-(5-methyl-3-isoxazolyl)propanamide
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