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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H17ClO2
Molecular Weight 192.683
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Octyl chloroformate

SMILES

CCCCCCCCOC(Cl)=O

InChI

InChIKey=VFXVAXFIFHSGNR-UHFFFAOYSA-N
InChI=1S/C9H17ClO2/c1-2-3-4-5-6-7-8-12-9(10)11/h2-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H17ClO2
Molecular Weight 192.683
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 12:30:32 GMT 2023
Edited
by admin
on Sat Dec 16 12:30:32 GMT 2023
Record UNII
6TN2WP97MB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Octyl chloroformate
Common Name English
1-Octyl chloroformate
Common Name English
Carbonochloridic acid, octyl ester
Systematic Name English
Octyl carbonochloridate
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
231-224-9
Created by admin on Sat Dec 16 12:30:32 GMT 2023 , Edited by admin on Sat Dec 16 12:30:32 GMT 2023
PRIMARY
PUBCHEM
81956
Created by admin on Sat Dec 16 12:30:32 GMT 2023 , Edited by admin on Sat Dec 16 12:30:32 GMT 2023
PRIMARY
CAS
7452-59-7
Created by admin on Sat Dec 16 12:30:32 GMT 2023 , Edited by admin on Sat Dec 16 12:30:32 GMT 2023
PRIMARY
FDA UNII
6TN2WP97MB
Created by admin on Sat Dec 16 12:30:32 GMT 2023 , Edited by admin on Sat Dec 16 12:30:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID9064710
Created by admin on Sat Dec 16 12:30:32 GMT 2023 , Edited by admin on Sat Dec 16 12:30:32 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY