(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoic acid
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(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoic acid
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CAS No:
27268-07-1
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Formula:
C13H11ClN2O2
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Chemical Name:
(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoic acid
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Synonyms:
3-(5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-acrylic acid;SCHEMBL15765083;HMS1787N02;ZINC3282480;(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoic acid;AKOS000304741;27268-07-1;SR-01000047304;SR-01000047304-1
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CAS No:
(E)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enoic acid Basic Attributes
262.69 g/mol
262.0509053 g/mol
Computed Properties
Molecular Weight:262.69
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:262.0509053
Monoisotopic Mass:262.0509053
Topological Polar Surface Area:55.1
Heavy Atom Count:18
Complexity:329
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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