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

Modify Date: 2025-09-29 10:30:24

Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl- Structure
Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl- structure
 Common Name Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl-
CAS Number 73663-78-2 Molecular Weight 264.32200
Density 1.154g/cm3 Boiling Point 393.7ºC at 760 mmHg
Molecular Formula C17H16N2O Melting Point N/A
MSDS N/A Flash Point 191.9ºC

 Names

Name 4-(N-methylanilino)-3-oxo-2-phenylbutanenitrile
Synonym More Synonyms

 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
InChIKey DZBBLJWSVLNSSO-UHFFFAOYSA-N
SMILES CN(CC(=O)C(C#N)c1ccccc1)c1ccccc1

 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

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

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
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Chemsrc provides CAS#:73663-78-2 MSDS, density, melting point, boiling point, structure, etc. Its name is Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl->> amp version: Acetoacetonitrile, 4-(N-methylanilino)-2-phenyl-

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