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Details

Stereochemistry ACHIRAL
Molecular Formula C13H15N
Molecular Weight 185.2649
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PHENYLCYCLOHEXANECARBONITRILE

SMILES

N#CC1(CCCCC1)C2=CC=CC=C2

InChI

InChIKey=AUXIEQKHXAYAHG-UHFFFAOYSA-N
InChI=1S/C13H15N/c14-11-13(9-5-2-6-10-13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-10H2

HIDE SMILES / InChI

Molecular Formula C13H15N
Molecular Weight 185.2649
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:14:48 GMT 2025
Edited
by admin
on Wed Apr 02 10:14:48 GMT 2025
Record UNII
A7PJG8E4XS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-PHENYLCYCLOHEXANECARBONITRILE
Systematic Name English
NSC-106872
Preferred Name English
1-PHENYLCYCLOHEXANE-1-CARBONITRILE
Systematic Name English
CYCLOHEXANECARBONITRILE, 1-PHENYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70176448
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY
CAS
2201-23-2
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY
FDA UNII
A7PJG8E4XS
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY
PUBCHEM
75148
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-608-1
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY
NSC
106872
Created by admin on Wed Apr 02 10:14:48 GMT 2025 , Edited by admin on Wed Apr 02 10:14:48 GMT 2025
PRIMARY