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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O
Molecular Weight 142.2386
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3,5-TRIMETHYLCYCLOHEXANOL, CIS-(±)-

SMILES

C[C@@H]1C[C@H](O)CC(C)(C)C1

InChI

InChIKey=BRRVXFOKWJKTGG-SFYZADRCSA-N
InChI=1S/C9H18O/c1-7-4-8(10)6-9(2,3)5-7/h7-8,10H,4-6H2,1-3H3/t7-,8+/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H18O
Molecular Weight 142.2386
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:33:07 GMT 2023
Edited
by admin
on Sat Dec 16 09:33:07 GMT 2023
Record UNII
3T046ESA4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3,5-TRIMETHYLCYCLOHEXANOL, CIS-(±)-
Systematic Name English
(1R,5R)-3,3,5-TRIMETHYLCYCLOHEXANOL, (±)-
Systematic Name English
CIS-3,5,5-TRIMETHYLCYCLOHEXANOL
Systematic Name English
CYCLOHEXANOL, 3,3,5-TRIMETHYL-, (1R,5R)-REL-
Systematic Name English
CIS-3,3,5-TRIMETHYLCYCLOHEXANOL
Systematic Name English
Code System Code Type Description
CAS
933-48-2
Created by admin on Sat Dec 16 09:33:07 GMT 2023 , Edited by admin on Sat Dec 16 09:33:07 GMT 2023
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EPA CompTox
DTXSID1047570
Created by admin on Sat Dec 16 09:33:07 GMT 2023 , Edited by admin on Sat Dec 16 09:33:07 GMT 2023
PRIMARY
PUBCHEM
101921
Created by admin on Sat Dec 16 09:33:07 GMT 2023 , Edited by admin on Sat Dec 16 09:33:07 GMT 2023
PRIMARY
FDA UNII
3T046ESA4Q
Created by admin on Sat Dec 16 09:33:07 GMT 2023 , Edited by admin on Sat Dec 16 09:33:07 GMT 2023
PRIMARY
ECHA (EC/EINECS)
213-268-0
Created by admin on Sat Dec 16 09:33:07 GMT 2023 , Edited by admin on Sat Dec 16 09:33:07 GMT 2023
PRIMARY