(Z)-4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid
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(Z)-4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid
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CAS No:
468747-44-6
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Formula:
C12H13NO5
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Chemical Name:
(Z)-4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid
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Synonyms:
(Z)-4-(3,4-DIMETHOXYPHENYLAMINO)-4-OXOBUT-2-ENOIC ACID;468747-44-6;(Z)-4-((3,4-Dimethoxyphenyl)amino)-4-oxobut-2-enoic acid;(Z)-4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid;ZINC5706552;AR2966;MFCD01185849;NSC333204;NSC-333204;AS-45490
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CAS No:
(Z)-4-(3,4-dimethoxyanilino)-4-oxobut-2-enoic acid Basic Attributes
251.23 g/mol
251.07937252 g/mol
333204
Computed Properties
Molecular Weight:251.23
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:251.07937252
Monoisotopic Mass:251.07937252
Topological Polar Surface Area:84.9
Heavy Atom Count:18
Complexity:328
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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