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Details

Stereochemistry RACEMIC
Molecular Formula C18H26
Molecular Weight 242.399
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1,1'-BICYCLOHEXYL)-3-YL-BENZENE, TRANS-

SMILES

C1CCC(CC1)[C@H]2CCC[C@@H](C2)C3=CC=CC=C3

InChI

InChIKey=ONQUBGYEUGJCEM-ROUUACIJSA-N
InChI=1S/C18H26/c1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16/h1,3-4,8-9,16-18H,2,5-7,10-14H2/t17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H26
Molecular Weight 242.399
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:19:33 GMT 2025
Edited
by admin
on Mon Mar 31 23:19:33 GMT 2025
Record UNII
819QTO5X90
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(1,1'-BICYCLOHEXYL)-3-YL-BENZENE, TRANS-
Common Name English
BENZENE, (1,1'-BICYCLOHEXYL)-3-YL-, TRANS-
Preferred Name English
BENZENE, (1R,3R)-(1,1'-BICYCLOHEXYL)-3-YL-, REL-
Systematic Name English
BICYCLOHEXYL, 3-PHENYL-, TRANS-
Systematic Name English
TRANS-1-CYCLOHEXYL-3-PHENYLCYCLOHEXANE
Systematic Name English
Code System Code Type Description
CAS
33460-03-6
Created by admin on Mon Mar 31 23:19:33 GMT 2025 , Edited by admin on Mon Mar 31 23:19:33 GMT 2025
PRIMARY
FDA UNII
819QTO5X90
Created by admin on Mon Mar 31 23:19:33 GMT 2025 , Edited by admin on Mon Mar 31 23:19:33 GMT 2025
PRIMARY
PUBCHEM
94775270
Created by admin on Mon Mar 31 23:19:33 GMT 2025 , Edited by admin on Mon Mar 31 23:19:33 GMT 2025
PRIMARY