4-CHLORO-2-(2,5-DIMETHYL-PYRROL-1-YL)-BENZOIC ACID
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4-CHLORO-2-(2,5-DIMETHYL-PYRROL-1-YL)-BENZOIC ACID
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CAS No:
335209-41-1
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Formula:
C13H12ClNO2
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Chemical Name:
4-CHLORO-2-(2,5-DIMETHYL-PYRROL-1-YL)-BENZOIC ACID
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Synonyms:
4-Chloro-2-(2,5-dimethyl-pyrrol-1-yl)-benzoic acid;4-chloro-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid;Oprea1_818006;Oprea1_876310;SCHEMBL14680352;CTK6G8594;HMS1610E01;ZINC244523;STK200540;AKOS000285764
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CAS No:
Computed Properties
Molecular Weight:249.69
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:249.0556563
Monoisotopic Mass:249.0556563
Topological Polar Surface Area:42.2
Heavy Atom Count:17
Complexity:287
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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