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821-57-8

821-57-8 structural image
Product Name: 7-CHLOROHEPTANOIC ACID
Formula: C7H13ClO2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1374

COMPUTED DESCRIPTORS

Molecular Weight 164.63 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 164.0604073 g/mol
Monoisotopic Mass 164.0604073 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 93.6
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