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862112-39-8

862112-39-8 structural image
Product Name: 3-(tert-butoxycarbonyl)-4-chlorobenzoic acid
Formula: C12H13ClO4
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COMPUTED DESCRIPTORS

Molecular Weight 256.68 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 256.0502366 g/mol
Monoisotopic Mass 256.0502366 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 308
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