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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H19ClO2
Molecular Weight 206.71
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Octan-2-yl 2-chloroacetate, (1R)-

SMILES

CCCCCC[C@@H](C)OC(=O)CCl

InChI

InChIKey=IJDHTIMWHATBKH-SECBINFHSA-N
InChI=1S/C10H19ClO2/c1-3-4-5-6-7-9(2)13-10(12)8-11/h9H,3-8H2,1-2H3/t9-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Acetic acid, 2-chloro-, (1R)-1-methylheptyl ester
Preferred Name English
Octan-2-yl 2-chloroacetate, (1R)-
Systematic Name English
(1R)-1-Methylheptyl 2-chloroacetate
Systematic Name English
Code System Code Type Description
FDA UNII
F3D3YB7UMU
Created by admin on Wed Apr 02 15:31:03 GMT 2025 , Edited by admin on Wed Apr 02 15:31:03 GMT 2025
PRIMARY
CAS
1016165-87-9
Created by admin on Wed Apr 02 15:31:03 GMT 2025 , Edited by admin on Wed Apr 02 15:31:03 GMT 2025
PRIMARY
PUBCHEM
86309112
Created by admin on Wed Apr 02 15:31:03 GMT 2025 , Edited by admin on Wed Apr 02 15:31:03 GMT 2025
PRIMARY
NIH
NCATS
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