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

Details

Stereochemistry ABSOLUTE
Molecular Formula C7H12BrClO
Molecular Weight 227.527
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (3R)-3-(Bromomethyl)hexanoyl chloride

SMILES

CCC[C@@H](CBr)CC(Cl)=O

InChI

InChIKey=WBXTVADBTVYKBI-ZCFIWIBFSA-N
InChI=1S/C7H12BrClO/c1-2-3-6(5-8)4-7(9)10/h6H,2-5H2,1H3/t6-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(3R)-3-(Bromomethyl)hexanoyl chloride
Systematic Name English
Hexanoyl chloride, 3-(bromomethyl)-, (3R)-
Preferred Name English
Code System Code Type Description
CAS
2101641-94-3
Created by admin on Wed Apr 02 19:43:43 GMT 2025 , Edited by admin on Wed Apr 02 19:43:43 GMT 2025
PRIMARY
PUBCHEM
141480109
Created by admin on Wed Apr 02 19:43:43 GMT 2025 , Edited by admin on Wed Apr 02 19:43:43 GMT 2025
PRIMARY
FDA UNII
LL46BNQ64E
Created by admin on Wed Apr 02 19:43:43 GMT 2025 , Edited by admin on Wed Apr 02 19:43:43 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966