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Homecas37079-04-2

37079-04-2

37079-04-2 structural image
Product Name: Acetic acid, 2,2-dichloro-, hexyl ester
Formula: C8H14Cl2O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1260 1270 1270 1270 1273 1268 1278 1298 1267 1285.5

COMPUTED DESCRIPTORS

Molecular Weight 213.10 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 7
Exact Mass 212.0370851 g/mol
Monoisotopic Mass 212.0370851 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 126
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes