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2305-30-8

2305-30-8 structural image
Product Name: 1,3-Cyclohexanedicarboxylic acid, (1R,3R)-rel-
Formula: C8H12O4
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COMPUTED DESCRIPTORS

Molecular Weight 172.18 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 172.07355886 g/mol
Monoisotopic Mass 172.07355886 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 179
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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