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63966-96-1

63966-96-1 structural image
Product Name: 3-Amino-4-chlorobenzoic acid 2-dodecyloxy-1-methyl-2-oxoethyl ester
Formula: C22H34ClNO4
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COMPUTED DESCRIPTORS

Molecular Weight 412.0 g/mol
XLogP3 7.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 16
Exact Mass 411.2176363 g/mol
Monoisotopic Mass 411.2176363 g/mol
Topological Polar Surface Area 78.6 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 446
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes