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Details

Stereochemistry RACEMIC
Molecular Formula C13H16ClNO
Molecular Weight 237.725
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-Chlorophenyl)-2-(methylamino)cyclohexanone

SMILES

CNC1(CCCCC1=O)C2=CC(Cl)=CC=C2

InChI

InChIKey=NDVCZDFFOQKAGV-UHFFFAOYSA-N
InChI=1S/C13H16ClNO/c1-15-13(8-3-2-7-12(13)16)10-5-4-6-11(14)9-10/h4-6,9,15H,2-3,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C13H16ClNO
Molecular Weight 237.725
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 Wed Apr 02 17:51:32 GMT 2025
Edited
by admin
on Wed Apr 02 17:51:32 GMT 2025
Record UNII
B679BM5TF7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-Chlorophenyl)-2-(methylamino)cyclohexanone
Systematic Name English
2-(3-Chlorophenyl)-2-(methylamino)cyclohexan-1-one
Preferred Name English
Cyclohexanone, 2-(3-chlorophenyl)-2-(methylamino)-
Systematic Name English
Code System Code Type Description
PUBCHEM
5228581
Created by admin on Wed Apr 02 17:51:32 GMT 2025 , Edited by admin on Wed Apr 02 17:51:32 GMT 2025
PRIMARY
FDA UNII
B679BM5TF7
Created by admin on Wed Apr 02 17:51:32 GMT 2025 , Edited by admin on Wed Apr 02 17:51:32 GMT 2025
PRIMARY
CAS
93307-20-1
Created by admin on Wed Apr 02 17:51:32 GMT 2025 , Edited by admin on Wed Apr 02 17:51:32 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE