Phenyl(diethylamino)acetonitrile

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Names

[ CAS No. ]:
5097-99-4

[ Name ]:
Phenyl(diethylamino)acetonitrile

[Synonym ]:
Diaethylamino-phenyl-acetonitril
diethylamino-phenyl-acetonitrile

Chemical & Physical Properties

[ Density]:
0.992g/cm3

[ Boiling Point ]:
274.6ºC at 760 mmHg

[ Molecular Formula ]:
C12H16N2

[ Molecular Weight ]:
188.26900

[ Flash Point ]:
105.2ºC

[ Exact Mass ]:
188.13100

[ PSA ]:
27.03000

[ LogP ]:
2.59308

[ Index of Refraction ]:
1.523

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AL9275000
CHEMICAL NAME :
Acetonitrile, (diethylamino)phenyl-
CAS REGISTRY NUMBER :
5097-99-4
BEILSTEIN REFERENCE NO. :
2099346
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H16-N2
MOLECULAR WEIGHT :
188.30
WISWESSER LINE NOTATION :
NC1R XN2&2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 12,447,1904

Safety Information

[ HS Code ]:
2926909090

Precursor & DownStream

Precursor

DownStream

  • N,N-diethyl-1-phenylethane-1,2-diamine
  • 1,2-DIBENZOYLETHANE
  • benzyldiethylamine
  • Mandelic acid
  • Diethylamine
  • N,N-diethyl-1,3-diphenylpropan-1-amine
  • N,N-DIETHYLBENZAMIDE
  • [cyano(phenyl)methyl]-diethyl-methylazanium,iodide

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 2-(Diethylamino)acetonitrile-d10
  • mercapto-phenyl-acetonitrile
  • dicyclohexyl-phenyl-acetonitrile
  • Methylamino-phenyl-acetonitrile hydrochloride
  • chlorocarbonyloxyimino-phenyl-acetonitrile
  • (4-benzoyloxy-phenyl)-acetonitrile
  • 1-{[(4-Fluorophenyl)sulfanyl]methyl}cyclopentan-1-ol
  • C-(2',4'-dichloro-4-fluoro-biphenyl-3-yl)-methylamine
  • 4-Thiazolidinecarboxylic acid, 2-methyl-3-[(4-propyl-1-piperidinyl)carbonyl]-
  • 2',4'-Dichloro-5-fluoro-biphenyl-2-ylamine
  • 1-(sec-butyl)-1H-pyrazole-4-carboxylic acid
  • 5-Bromo-2-(2-fluoro-4-trifluoromethyl-benzoylamino)-benzoic acid
  • 4-[(Dicyclopropylmethyl)amino]butan-2-ol
  • 4-[(Cyclohexylmethyl)amino]butan-2-ol
  • 5-Methyl-2-(piperidin-4-ylmethyl)pyridine
  • 1-(2-cyclopropylphenyl)-N-methylmethanamine
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