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Details

Stereochemistry RACEMIC
Molecular Formula C11H20O
Molecular Weight 168.2759
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-TERT-PENTYLCYCLOHEXANONE

SMILES

CCC(C)(C)C1CCCC(=O)C1

InChI

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

HIDE SMILES / InChI

Molecular Formula C11H20O
Molecular Weight 168.2759
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:12:34 GMT 2023
Edited
by admin
on Sat Dec 16 11:12:34 GMT 2023
Record UNII
O0F4BYY71M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-TERT-PENTYLCYCLOHEXANONE
Systematic Name English
3-ISOPENTYLCYCLOHEXANONE
Systematic Name English
CYCLOHEXANONE, 3-(1,1-DIMETHYLPROPYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
O0F4BYY71M
Created by admin on Sat Dec 16 11:12:34 GMT 2023 , Edited by admin on Sat Dec 16 11:12:34 GMT 2023
PRIMARY
PUBCHEM
23552181
Created by admin on Sat Dec 16 11:12:34 GMT 2023 , Edited by admin on Sat Dec 16 11:12:34 GMT 2023
PRIMARY
EPA CompTox
DTXSID301292673
Created by admin on Sat Dec 16 11:12:34 GMT 2023 , Edited by admin on Sat Dec 16 11:12:34 GMT 2023
PRIMARY
CAS
171860-70-1
Created by admin on Sat Dec 16 11:12:34 GMT 2023 , Edited by admin on Sat Dec 16 11:12:34 GMT 2023
PRIMARY