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Details

Stereochemistry ACHIRAL
Molecular Formula C11H20O
Molecular Weight 168.2759
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-TERT-PENTYLCYCLOHEXANONE

SMILES

CCC(C)(C)C1CCC(=O)CC1

InChI

InChIKey=DCSKAMGZSIRJAQ-UHFFFAOYSA-N
InChI=1S/C11H20O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9H,4-8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H20O
Molecular Weight 168.2759
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 Mon Mar 31 23:45:51 GMT 2025
Edited
by admin
on Mon Mar 31 23:45:51 GMT 2025
Record UNII
5380BWU79X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ORIVONE
Preferred Name English
4-TERT-PENTYLCYCLOHEXANONE
Systematic Name English
CYCLOHEXANONE, 4-(1,1-DIMETHYLPROPYL)-
Systematic Name English
4-(TERT-PENTYL)-CYCLOHEXANONE
Systematic Name English
NSC-21167
Code English
4-ISOPENTYLCYCLOHEXANONE
Systematic Name English
4-TERT-AMYLCYCLOHEXANONE
Systematic Name English
4-(1,1-DIMETHYLPROPYL)CYCLOHEXANONE
Systematic Name English
CYCLOHEXANONE, 4-TERT-PENTYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID4047127
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY
CAS
16587-71-6
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY
NSC
21167
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY
ECHA (EC/EINECS)
240-642-0
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY
FDA UNII
5380BWU79X
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY
PUBCHEM
27941
Created by admin on Mon Mar 31 23:45:52 GMT 2025 , Edited by admin on Mon Mar 31 23:45:52 GMT 2025
PRIMARY