Butyl nicotinate

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Names

[ CAS No. ]:
6938-06-3

[ Name ]:
Butyl nicotinate

[Synonym ]:
EINECS 230-064-7
3-Pyridinecarboxylic acid, butyl ester
Butyl nicotinate
butyl pyridine-3-carboxylate
MFCD00006390
Nicotinic acid butyl ester

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
260.2±0.0 °C at 760 mmHg

[ Melting Point ]:
252ºC

[ Molecular Formula ]:
C10H13NO2

[ Molecular Weight ]:
179.216

[ Flash Point ]:
106.5±19.8 °C

[ Exact Mass ]:
179.094635

[ PSA ]:
39.19000

[ LogP ]:
2.48

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.500

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QT0875000
CHEMICAL NAME :
Nicotinic acid, butyl ester
CAS REGISTRY NUMBER :
6938-06-3
BEILSTEIN REFERENCE NO. :
0132654
LAST UPDATED :
199712
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H13-N-O2
MOLECULAR WEIGHT :
179.24
WISWESSER LINE NOTATION :
T6NJ CVO4

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
63 mg/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

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39

[ RTECS ]:
QT0875000

[ HS Code ]:
2933399090

Synthetic Route

Click to get detail synthetic route

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

  • tert-Butyl nicotinate
  • butyl 4-[(1-cyano-3-phenylprop-2-enyl)amino]benzoate
  • butyl 4-[[cyano-(3,4-dimethoxyphenyl)methyl]amino]benzoate
  • butyl 4-[[cyano(furan-2-yl)methyl]amino]benzoate
  • butyl(ethyl)diazene
  • butyl 3-methyl-3-phenyloxirane-2-carboxylate
  • 2-(5-acetamido-1H-indol-3-yl)acetic acid
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • O-[2-(4-methyl-3,4-dihydro-2H-1,4-benzoxazin-6-yl)ethyl]hydroxylamine
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine