2-cyano-3-methylbut-2-enoic acid
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2-cyano-3-methylbut-2-enoic acid
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CAS No:
759-21-7
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Formula:
C6H7NO2
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Chemical Name:
2-cyano-3-methylbut-2-enoic acid
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Synonyms:
2-Cyano-3-methyl-2-butenoic Acid;759-21-7;2-cyano-3-methylbut-2-enoic acid;2-Butenoic acid, 2-cyano-3-methyl-;MFCD00192788;isopropylidene cyanoacetic acid;NSC98287;NCIOpen2_001761;SCHEMBL1437550;DTXSID40294805;ZINC4558302;2-cyano-3-methyl-but-2-enoic acid;5529AJ;NSC-98287;AKOS006379377;MCULE-7102466999;CS-11708;DA-26348;SY028623;FT-0721020
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CAS No:
2-cyano-3-methylbut-2-enoic acid Basic Attributes
125.13 g/mol
125.047678466 g/mol
98287
DTXSID40294805
Computed Properties
Molecular Weight:125.13
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:125.047678466
Monoisotopic Mass:125.047678466
Topological Polar Surface Area:61.1
Heavy Atom Count:9
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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