APAAN

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H9NO
Molecular Weight	159.1846
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0
Stereo Comments	Assumed racemic

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)C(C#N)C1=CC=CC=C1

InChI

InChIKey=KHNWFTMUBKJWRZ-UHFFFAOYSA-N

InChI=1S/C10H9NO/c1-8(12)10(7-11)9-5-3-2-4-6-9/h2-6,10H,1H3

HIDE SMILES / InChI

Molecular Formula	C10H9NO
Molecular Weight	159.1846
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:57:33 UTC 2023` Edited by `admin` on `Sat Dec 16 12:57:33 UTC 2023`
Record UNII	302PX39407
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

APAAN

Common Name

English

.ALPHA.-ACETYLPHENYLACETONITRILE

Systematic Name

English

UN3439

Code

English

ALPHA-PHENYLACETOACETONILTRILE

Common Name

English

NSC-25183

Code

English

2-PHENYLACETOACETONITRILE

Common Name

English

BENZENEACETONITRILE, ALPHA-ACETYL-

Systematic Name

English

NSC-55206

Code

English

NSC-11777

Code

English

DEA NO. 8512

Code

English

2-ACETYL-2-PHENYLACETONITRILE

Systematic Name

English

Classification Tree Code System Code

DEA NO.

8512