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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H46O2
Molecular Weight 390.6422
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [2,2-Bis(nonyloxy)ethyl]benzene

SMILES

CCCCCCCCCOC(CC1=CC=CC=C1)OCCCCCCCCC

InChI

InChIKey=GUGANXZUIVXJBG-UHFFFAOYSA-N
InChI=1S/C26H46O2/c1-3-5-7-9-11-13-18-22-27-26(24-25-20-16-15-17-21-25)28-23-19-14-12-10-8-6-4-2/h15-17,20-21,26H,3-14,18-19,22-24H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C26H46O2
Molecular Weight 390.6422
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:26:40 GMT 2023
Edited
by admin
on Sat Dec 16 12:26:40 GMT 2023
Record UNII
28MVQ8K35H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
[2,2-Bis(nonyloxy)ethyl]benzene
Systematic Name English
Benzene, [2,2-bis(nonyloxy)ethyl]-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40240089
Created by admin on Sat Dec 16 12:26:40 GMT 2023 , Edited by admin on Sat Dec 16 12:26:40 GMT 2023
PRIMARY
PUBCHEM
3023163
Created by admin on Sat Dec 16 12:26:40 GMT 2023 , Edited by admin on Sat Dec 16 12:26:40 GMT 2023
PRIMARY
FDA UNII
28MVQ8K35H
Created by admin on Sat Dec 16 12:26:40 GMT 2023 , Edited by admin on Sat Dec 16 12:26:40 GMT 2023
PRIMARY
CAS
93981-53-4
Created by admin on Sat Dec 16 12:26:40 GMT 2023 , Edited by admin on Sat Dec 16 12:26:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
301-139-2
Created by admin on Sat Dec 16 12:26:40 GMT 2023 , Edited by admin on Sat Dec 16 12:26:40 GMT 2023
PRIMARY