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2-Phenylacetoacetonitrile

CAS No.
4468-48-8
Chemical Name:
2-Phenylacetoacetonitrile
Synonyms
alpha-phenylacetoacetonitrile;3-Oxo-2-phenylbutanenitrile;α-Acetylphenylacetonitrile;2-Phenyl-3-oxobutanenitrile;2-OXO-1-PHENYLPROPYL CYANIDE;A-ACETYL BENZENEACETONITRIDE;BENZENEACETONITRILE, -ACETYL-;2-acetyl-2-phenyl-acetonitril;ALPHA-ACETYLPHENYLACETONITRILE;alpha-Phenylacetyl Acetonitrile
CBNumber:
CB7410301
Molecular Formula:
C10H9NO
Molecular Weight:
159.19
MDL Number:
MFCD00001867
MOL File:
4468-48-8.mol
Last updated:2023-04-23 13:52:06

2-Phenylacetoacetonitrile Properties

Melting point 92-94 °C(lit.)
Boiling point 284.68°C (rough estimate)
Density 1.1202 (rough estimate)
refractive index 1.5460 (estimate)
storage temp. -20°C Freezer
solubility DMF: 30 mg/ml; DMF:PBS (pH 7.2); (1:7): 0.12 mg/ml; DMSO: 25 mg/ml; Ethanol: 15 mg/ml
form A crystalline solid
color Crystals from EtOH (aq) or EtOAc/pet ether
CAS DataBase Reference 4468-48-8(CAS DataBase Reference)
FDA UNII 302PX39407
EPA Substance Registry System Benzeneacetonitrile, .alpha.-acetyl- (4468-48-8)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302+H312+H332-H315-H319-H335
Precautionary statements  P260-P280-P312
Hazard Codes  Xn,Xi
Risk Statements  20/21/22-36/37/38
Safety Statements  26-37/39
RIDADR  UN 3439 6.1/PG 3
WGK Germany  3
RTECS  AL7708000
HazardClass  IRRITANT
HS Code  2926907090
Toxicity LD50 ipr-mus: 200 mg/kg NTIS** AD277-689
NFPA 704
0
1 0

2-Phenylacetoacetonitrile Chemical Properties,Uses,Production

Chemical Properties

Light Yellow Solid

Uses

2-Phenylacetoacetonitrile is an analytical reference standard categorized as a precursor in the synthesis of amphetamines.This product is intended for research and forensic applications.

Safety Profile

Poison by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx and CNí.

2-Phenylacetoacetonitrile Preparation Products And Raw materials

Raw materials

Preparation Products

2-phenyl-acetoacetonitril acetonitrile,phenylaceto phenylaceto-acetonitrile usafpe-1 alpha-acetyl benzene acetonitride α-Acetyl Benzeneacetonitride Alpha-Acetyl Acetoacetonitrile, 2-phenyl- 2-Acetyl-2-phenylethanenitrile α-Acetylbenzeneacetonitrile alpha-Acetyl-phenylacetonitrile,99% 2-Acetyl benzeneacetonitride 1-Cyano-1-phenylpropan-2-one NSC 25183 NSC 55206 A-ACETYLPHENYLACETONITRILE AKOS BBS-00002636 ALPHA-ACETYL BENZENEACETONITRILE 2-PHENYLACETOACETONITRILE Benzeneacetonitrile, a-acetyl- BENZENEACETONITRILE, ALPHA-ACETYL- 3-OXO-2-PHENYLBUTYRONITRILE 1-Phenyl-1-Cyanopropan-2-One α-Acetylphenylacetonitrile 2-Phenyl-3-oxobutanenitrile 2-OXO-1-PHENYLPROPYL CYANIDE ALPHA-ACETYLPHENYLACETONITRILE 3-Oxo-2-phenylbutanenitrile alpha-Phenylacetyl Acetonitrile A-ACETYL BENZENEACETONITRIDE BENZENEACETONITRILE, -ACETYL- alpha-phenylacetoacetonitrile alpha-acetyl-benzeneacetonitril 2-acetyl-2-phenyl-acetonitril α-Phenylacetoacetonitrile Benzeneacetonitrile, α-acetyl- 4468-48-8 4468-68-8 C6H5CHCOCH3CN C10 to C27 Building Blocks Organic Building Blocks Nitrogen Compounds Cyanides/Nitriles Aromatics Miscellaneous Reagents