U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C18H22
Molecular Weight 238.3673
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(1-METHYLPROPYL)-2-(1-PHENYLETHYL)BENZENE

SMILES

CCC(C)C1=C(C=CC=C1)C(C)C2=CC=CC=C2

InChI

InChIKey=VKYRZTVKECTZKE-UHFFFAOYSA-N
InChI=1S/C18H22/c1-4-14(2)17-12-8-9-13-18(17)15(3)16-10-6-5-7-11-16/h5-15H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C18H22
Molecular Weight 238.3673
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 19:55:59 GMT 2025
Edited
by admin
on Tue Apr 01 19:55:59 GMT 2025
Record UNII
O0X4569K5Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(1-METHYLPROPYL)-2-(1-PHENYLETHYL)BENZENE
Preferred Name English
Code System Code Type Description
FDA UNII
O0X4569K5Y
Created by admin on Tue Apr 01 19:55:59 GMT 2025 , Edited by admin on Tue Apr 01 19:55:59 GMT 2025
PRIMARY
PUBCHEM
18968302
Created by admin on Tue Apr 01 19:55:59 GMT 2025 , Edited by admin on Tue Apr 01 19:55:59 GMT 2025
PRIMARY