methyl 3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
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methyl 3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
structure -
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CAS No:
22071-10-9
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Formula:
C6H5Cl3N2O2
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Chemical Name:
methyl 3-amino-4,4,4-trichloro-2-cyanobut-2-enoate
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Synonyms:
DTXSID70326981;2-Butenoic acid, 3-amino-4,4,4-trichloro-2-cyano-, methyl ester;22071-10-9;NCI60_007659
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CAS No:
methyl 3-amino-4,4,4-trichloro-2-cyanobut-2-enoate Basic Attributes
243.5 g/mol
241.941660 g/mol
DTXSID70326981
Computed Properties
Molecular Weight:243.5
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:241.941660
Monoisotopic Mass:241.941660
Topological Polar Surface Area:76.1
Heavy Atom Count:13
Complexity:297
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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