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428495-29-8

428495-29-8 structural image
Product Name: 2-CHLORO-5-(3-FORMYL-2,5-DIMETHYL-1H-PYRROL-1-YL)BENZOIC ACID
Formula: C14H12ClNO3
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COMPUTED DESCRIPTORS

Molecular Weight 277.70 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 277.0505709 g/mol
Monoisotopic Mass 277.0505709 g/mol
Topological Polar Surface Area 59.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 363
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