3-(4-bromothiophen-2-yl)-2-cyanoprop-2-enoic acid
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3-(4-bromothiophen-2-yl)-2-cyanoprop-2-enoic acid
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CAS No:
1087780-82-2
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Formula:
C8H4BrNO2S
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Chemical Name:
3-(4-bromothiophen-2-yl)-2-cyanoprop-2-enoic acid
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Synonyms:
3-(4-Bromothiophen-2-yl)-2-cyanoprop-2-enoic acid;1087780-82-2;ZINC63110915;AKOS032963194
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CAS No:
Computed Properties
Molecular Weight:258.09
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:256.91461
Monoisotopic Mass:256.91461
Topological Polar Surface Area:89.3
Heavy Atom Count:13
Complexity:294
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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