ASISCHEM C63390
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ASISCHEM C63390
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CAS No:
915924-30-0
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Formula:
C8H8N2O2S
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Chemical Name:
ASISCHEM C63390
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Synonyms:
ASISCHEM C63390;CHEMBRDG-BB 4011775;(2E)-3-[2-(METHYLTHIO)PYRIMIDIN-5-YL]ACRYLIC ACID;(2E)-3-[2-(methylthio)pyrimidin-5-yl]acrylic acid(SALTDATA: FREE)
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CAS No:
Computed Properties
Molecular Weight:196.23
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:196.03064868
Monoisotopic Mass:196.03064868
Topological Polar Surface Area:88.4
Heavy Atom Count:13
Complexity:200
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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