Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl-

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Names

[ CAS No. ]:
73663-78-2

[ Name ]:
Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl-

[Synonym ]:
Acetonitrile,2-[2-(N-methylanilino)acetyl]-2-phenyl
Acetoacetonitrile,4-(N-methylanilino)-2-phenyl
4-(N-methyl-anilino)-2-phenyl-acetoacetonitrile
2-(2-(N-Methylanilino)acetyl)-2-phenylacetonitrile

Chemical & Physical Properties

[ Density]:
1.154g/cm3

[ Boiling Point ]:
393.7ºC at 760 mmHg

[ Molecular Formula ]:
C17H16N2O

[ Molecular Weight ]:
264.32200

[ Flash Point ]:
191.9ºC

[ Exact Mass ]:
264.12600

[ PSA ]:
44.10000

[ LogP ]:
2.99928

[ Index of Refraction ]:
1.605

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AM0900000
CHEMICAL NAME :
Acetonitrile, 2-(2-(N-methylanilino)acetyl)-2-phenyl-
CAS REGISTRY NUMBER :
73663-78-2
BEILSTEIN REFERENCE NO. :
3375694
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H16-N2-O
MOLECULAR WEIGHT :
264.35
WISWESSER LINE NOTATION :
NCYR&V1N1&R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06989

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Glycine,N-methyl-N-phenyl-, ethyl ester
  • Benzyl cyanide

DownStream

Related Compounds

  • bis[4-(N-methylanilino)phenyl]methanone
  • 1-[4-(N-methylanilino)phenyl]ethanone
  • 7,7-dichloro-6-(N-methylanilino)-2-phenyl-5,6-dihydro-4H-pyrano[3,2-g][1,3]benzothiazol-8-one
  • methyl 4-(N-methylanilino)-3-(2-phenylethynyl)benzoate
  • 1-[4-(N-methylanilino)phenyl]-3-phenylprop-2-en-1-one
  • 1-[4-(N-methylanilino)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one
  • 5,8-dichloro-1,2,3,4-tetrahydro-3-methyl-6,7-Isoquinolinediol hydrobromide
  • 5,8-dichloro-1,2,3,4-tetrahydro-6,7-dimethoxy-3-methylIsoquinoline hydrochloride
  • 5,8-Dichloro-1-methyl-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrobromide
  • 5,8-Dichloro-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
  • 5-[(2,3-Dihydro-1H-inden-2-yl)oxy]-1H-indazole-3-carboxylic acid
  • 5-[(Cyclopropylmethylamino)methyl]-1-methyl-1H-pyrazole-3-sulfonamide
  • 5-[(Tetrahydro-2H-pyran-4-yl)oxy]-1H-indazole-3-carboxylic acid
  • 5-[[(2-Hydroxyethyl)amino]carbonyl]-1H-pyrazole-3-carboxylic acid
  • 5-[[[2-(1H-Imidazol-5-yl)ethyl]amino]carbonyl]-1H-pyrazole-3-carboxylic acid
  • 5-[2-(1-Pyrrolidinyl)ethoxy]-1H-indazole-3-carboxylic acid
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