(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester
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(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester
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CAS No:
52632-17-4
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Formula:
C12H13N4O4
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Chemical Name:
(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester
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Synonyms:
UNII-TMU76O69XM;TMU76O69XM;Ethyl-3-(2-carbethoxy-2-cyanoethenyl)amino-1H-pyrazole-4-carboxylate, (E)-;(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)amino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester;321571-07-7;(E)-ethyl-3-(2-carbethoxy-2-cyanoethenyl)amino-1H-pyrazole-4-carboxylate;ethyl 5-[(2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl)amino]-1H-pyrazole-4-carboxylate;Allopurinol related compound F, (E)-;Allopurinol Impurity F;Allopurinol Related Compound F
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CAS No:
(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester Basic Attributes
277.25602
278.102
TMU76O69XM
DTXSID30200612
(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester Use and Manufacturing
An impurity of Allopurinol (A547300).
Computed Properties
Molecular Weight:278.26
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:278.10150494
Monoisotopic Mass:278.10150494
Topological Polar Surface Area:117
Heavy Atom Count:20
Complexity:440
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(E)-3-[(2-Cyano-3-ethoxy-3-oxo-1-propenyl)aMino]-1H-pyrazole-4-carboxylic Acid Ethyl Ester
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