(Z)-4-(2,5-dimethylanilino)-4-oxobut-2-enoic acid
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(Z)-4-(2,5-dimethylanilino)-4-oxobut-2-enoic acid
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CAS No:
31460-30-7
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Formula:
C12H13NO3
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Chemical Name:
(Z)-4-(2,5-dimethylanilino)-4-oxobut-2-enoic acid
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Synonyms:
NSC62643;31460-30-7;(Z)-4-(2,5-dimethylanilino)-4-oxobut-2-enoic acid;ARONIS010138;SCHEMBL14675747;DTXSID00364351;SMSF0003630;ZINC4579160;MFCD00443354;NSC-62643;STK026016;AKOS000499363;BIM-0009057.P001;ST45046865;SR-01000196568;SR-01000196568-1;(2Z)-3-[N-(2,5-dimethylphenyl)carbamoyl]prop-2-enoic acid;(2Z)-4-[(2,5-dimethylphenyl)amino]-4-oxobut-2-enoic acid
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CAS No:
(Z)-4-(2,5-dimethylanilino)-4-oxobut-2-enoic acid Basic Attributes
219.24 g/mol
219.08954328 g/mol
62643
DTXSID00364351
Computed Properties
Molecular Weight:219.24
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:219.08954328
Monoisotopic Mass:219.08954328
Topological Polar Surface Area:66.4
Heavy Atom Count:16
Complexity:299
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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