ChemicalBook--->CAS DataBase List--->119718-89-7

119718-89-7

119718-89-7 Structure

119718-89-7 Structure
IdentificationBack Directory
[Name]

(R)-ALPHA-CYANOBENZYL ACETATE
[CAS]

119718-89-7
[Synonyms]

D-MANDELONITRILE ACETATE
(r)-α-cyanobenzyl acetate
O-ACETYL-D-MANDELONITRILE
(R)-ALPHA-CYANOBENZYL ACETATE
(R)-ALPHA-ACETOXYPHENYLACETONITRILE
(R)-(+)-ALPHA-ACETOXYPHENYLACETONITRILE
Benzeneacetonitrile, α-(acetyloxy)-, (αR)-
(R)-α-Cyanobenzyl acetate, O-Acetyl-D-mandelonitrile
[Molecular Formula]

C10H9NO2
[MDL Number]

MFCD00191699
[MOL File]

119718-89-7.mol
[Molecular Weight]

175.18
Chemical PropertiesBack Directory
[Boiling point ]

268 °C(lit.)
[density ]

1.115 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.506
[Fp ]

>230 °F
[Optical Rotation]

[α]20/D +8.0±0.5°, c =10% in chloroform
[InChI]

1S/C10H9NO2/c1-8(12)13-10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3/t10-/m0/s1
[InChIKey]

MUXDFYRMYMEGCM-JTQLQIEISA-N
[SMILES]

CC(=O)O[C@@H](C#N)c1ccccc1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22-36/37/38
[Safety Statements ]

26-36
[RIDADR ]

UN 3276 6.1/PG 3
[WGK Germany ]

3
[F ]

3
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

(R)-α-Acetoxyphenylacetonitrile can be used as a model compound in the iodine promoted as well as t-BuONO-assisted secondary amides synthesis via an aryl?N-addition reaction to the -CN group of nitriles.
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