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Details

Stereochemistry RACEMIC
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Butylcyclohexanone

SMILES

CCCCC1CCCCC1=O

InChI

InChIKey=POYYYXPQBFPUKS-UHFFFAOYSA-N
InChI=1S/C10H18O/c1-2-3-6-9-7-4-5-8-10(9)11/h9H,2-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C10H18O
Molecular Weight 154.2493
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 11:19:37 GMT 2025
Edited
by admin
on Wed Apr 02 11:19:37 GMT 2025
Record UNII
P8S9CFY2WL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Butylcyclohexanone
Systematic Name English
NSC-60224
Preferred Name English
Cyclohexanone, 2-butyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
70771
Created by admin on Wed Apr 02 11:19:37 GMT 2025 , Edited by admin on Wed Apr 02 11:19:37 GMT 2025
PRIMARY
EPA CompTox
DTXSID501315255
Created by admin on Wed Apr 02 11:19:37 GMT 2025 , Edited by admin on Wed Apr 02 11:19:37 GMT 2025
PRIMARY
CAS
1126-18-7
Created by admin on Wed Apr 02 11:19:37 GMT 2025 , Edited by admin on Wed Apr 02 11:19:37 GMT 2025
PRIMARY
NSC
60224
Created by admin on Wed Apr 02 11:19:37 GMT 2025 , Edited by admin on Wed Apr 02 11:19:37 GMT 2025
PRIMARY
FDA UNII
P8S9CFY2WL
Created by admin on Wed Apr 02 11:19:37 GMT 2025 , Edited by admin on Wed Apr 02 11:19:37 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE