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Details

Stereochemistry MIXED
Molecular Formula C9H16O2
Molecular Weight 156.2225
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of 3,3,5-TRIMETHYL-4-HYDROXYCYCLOHEXAN-1-ONE

SMILES

CC1CC(=O)CC(C)(C)C1O

InChI

InChIKey=CZFNEULXUXGILY-UHFFFAOYSA-N
InChI=1S/C9H16O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6,8,11H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2225
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 23:35:29 GMT 2025
Edited
by admin
on Tue Apr 01 23:35:29 GMT 2025
Record UNII
8C72Q10O8G
Record Status FAILED
Record Version
  • Download
Name Type Language
3,3,5-TRIMETHYL-4-HYDROXYCYCLOHEXAN-1-ONE
Systematic Name English
4-HYDROXY-3,3,5-TRIMETHYLCYCLOHEXANONE
Preferred Name English
CYCLOHEXANONE, 4-HYDROXY-3,3,5-TRIMETHYL-
Systematic Name English
Code System Code Type Description
PUBCHEM
21200670
Created by admin on Tue Apr 01 23:35:29 GMT 2025 , Edited by admin on Tue Apr 01 23:35:29 GMT 2025
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FDA UNII
8C72Q10O8G
Created by admin on Tue Apr 01 23:35:29 GMT 2025 , Edited by admin on Tue Apr 01 23:35:29 GMT 2025
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EPA CompTox
DTXSID301283137
Created by admin on Tue Apr 01 23:35:29 GMT 2025 , Edited by admin on Tue Apr 01 23:35:29 GMT 2025
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CAS
20548-03-2
Created by admin on Tue Apr 01 23:35:29 GMT 2025 , Edited by admin on Tue Apr 01 23:35:29 GMT 2025
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