Dichloroacetic acid 3-methylbutyl ester structure

Dichloroacetic acid 3-methylbutyl ester

3-methylbutyl 2,2-dichloroacetate

Also Known As: Dichloroacetic acid 3-methylbutyl ester|Isopentyl dichloroacetate|Isopentyl dichloroacetate #|3-Methylbutyl dichloroacetate|isopentyl 2,2-dichloroacetate|3-methylbutyl 2,2-dichloroacetate|3-methylbutyl2,2-dichloroacetate|Dichloroacetic acid, 3-methylbutyl ester|Acetic acid, dichloro, 3-methylbutyl ester|Acetic acid, dichloro-, 3-methylbutyl ester|Acetic acid,2,2-dichloro-,3-methylbutyl ester|Acetic acid,2,2-dichloro-, 3-methylbutyl ester

CAS: 37587-83-0
Molecular Formula C7H12Cl2O2
Molecular Weight 198.02144 g/mol
LogP 3.1
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 5
Exact Mass 198.02144
Monoisotopic Mass 198.02144
Heavy Atoms 11
Complexity 124.0

Chemical Identifiers

CAS Number 37587-83-0
SMILES CC(C)CCOC(=O)C(Cl)Cl
InChIKey UQQSGXRKRFDREY-UHFFFAOYSA-N

Product Overview

Dichloroacetic acid 3-methylbutyl ester (CAS 37587-83-0), with molecular formula C7H12Cl2O2 and molecular weight 198.02144 g/mol. IUPAC: 3-methylbutyl 2,2-dichloroacetate.

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