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Details

Stereochemistry RACEMIC
Molecular Formula C16H13NO
Molecular Weight 235.2811
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-BENZOYLPHENYL)PROPIONITRILE

SMILES

CC(C#N)c1cccc(c1)C(=O)c2ccccc2

InChI

InChIKey=RGYOCHMZSLUCNP-UHFFFAOYSA-N
InChI=1S/C16H13NO/c1-12(11-17)14-8-5-9-15(10-14)16(18)13-6-3-2-4-7-13/h2-10,12H,1H3

HIDE SMILES / InChI

Molecular Formula C16H13NO
Molecular Weight 235.2811
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 Jun 26 04:14:10 UTC 2021
Edited
by admin
on Sat Jun 26 04:14:10 UTC 2021
Record UNII
T1XT2245YV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-BENZOYLPHENYL)PROPIONITRILE
Systematic Name English
KETOPROFEN RELATED COMPOUND F
USP-RS  
Common Name English
KETOPROFEN SPECIFIED IMPURITY F [EP]
Common Name English
KETOPROFEN RELATED COMPOUND F [USP-RS]
Common Name English
2-(3-BENZOYLPHENYL)PROPANENITRILE
Systematic Name English
BENZENEACETONITRILE, 3-BENZOYL-.ALPHA.-METHYL-
Systematic Name English
KETOPROFEN IMPURITY F [USP-RC]
Common Name English
2-(M-BENZOYLPHENYL)PROPIONITRILE
Systematic Name English
2-(3-BENZOYLPHENYL)PROPIONITRILE, (+/-)-
Systematic Name English
Code System Code Type Description
FDA UNII
T1XT2245YV
Created by admin on Sat Jun 26 04:14:11 UTC 2021 , Edited by admin on Sat Jun 26 04:14:11 UTC 2021
PRIMARY
ECHA (EC/EINECS)
255-982-5
Created by admin on Sat Jun 26 04:14:11 UTC 2021 , Edited by admin on Sat Jun 26 04:14:11 UTC 2021
PRIMARY
PUBCHEM
39325
Created by admin on Sat Jun 26 04:14:11 UTC 2021 , Edited by admin on Sat Jun 26 04:14:11 UTC 2021
PRIMARY
USP_CATALOG
1356585
Created by admin on Sat Jun 26 04:14:11 UTC 2021 , Edited by admin on Sat Jun 26 04:14:11 UTC 2021
PRIMARY USP-RS
CAS
42872-30-0
Created by admin on Sat Jun 26 04:14:11 UTC 2021 , Edited by admin on Sat Jun 26 04:14:11 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY