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Details

Stereochemistry RACEMIC
Molecular Formula C9H18
Molecular Weight 126.2392
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4-Trimethylcyclohexane, trans, cis-

SMILES

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

InChI

InChIKey=VCJPCEVERINRSG-IWSPIJDZSA-N
InChI=1S/C9H18/c1-7-4-5-8(2)9(3)6-7/h7-9H,4-6H2,1-3H3/t7-,8-,9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H18
Molecular Weight 126.2392
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:10:33 GMT 2025
Edited
by admin
on Wed Apr 02 21:10:33 GMT 2025
Record UNII
A2R222BM7D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-73967
Preferred Name English
1,2,4-Trimethylcyclohexane, trans, cis-
Systematic Name English
Cyclohexane, 1,2,4-trimethyl-, (1R,2R,4R)-rel-
Systematic Name English
trans, cis-1,2,4-Trimethylcyclohexane
Systematic Name English
Cyclohexane, 1,2,4-trimethyl-, (1?,2?,4?)-
Systematic Name English
rel-(1R,2R,4R)-1,2,4-Trimethylcyclohexane
Systematic Name English
Cyclohexane, 1,2,4-trimethyl-, trans,cis-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID201025631
Created by admin on Wed Apr 02 21:10:33 GMT 2025 , Edited by admin on Wed Apr 02 21:10:33 GMT 2025
PRIMARY
CAS
7667-60-9
Created by admin on Wed Apr 02 21:10:33 GMT 2025 , Edited by admin on Wed Apr 02 21:10:33 GMT 2025
PRIMARY
PUBCHEM
6432704
Created by admin on Wed Apr 02 21:10:33 GMT 2025 , Edited by admin on Wed Apr 02 21:10:33 GMT 2025
PRIMARY
FDA UNII
A2R222BM7D
Created by admin on Wed Apr 02 21:10:33 GMT 2025 , Edited by admin on Wed Apr 02 21:10:33 GMT 2025
PRIMARY
NSC
73967
Created by admin on Wed Apr 02 21:10:33 GMT 2025 , Edited by admin on Wed Apr 02 21:10:33 GMT 2025
PRIMARY