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33472-67-2

33472-67-2 structural image
Product Name: 3-[ethyl(hydroxy)phosphoryl]but-2-enoic acid
Formula: C6H11O4P
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COMPUTED DESCRIPTORS

Molecular Weight 178.12 g/mol
XLogP3 -0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 178.03949583 g/mol
Monoisotopic Mass 178.03949583 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 231
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes