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749920-21-6

749920-21-6 structural image
Product Name: 3-CHLORO-5-METHOXY-4-(3-METHYLBUTOXY)BENZOIC ACID
Formula: C13H17ClO4
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COMPUTED DESCRIPTORS

Molecular Weight 272.72 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 272.0815367 g/mol
Monoisotopic Mass 272.0815367 g/mol
Topological Polar Surface Area 55.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 270
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

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