ASISCHEM C63391
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ASISCHEM C63391
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CAS No:
915921-69-6
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Formula:
C9H10N2O2S
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Chemical Name:
ASISCHEM C63391
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Synonyms:
CHEMBRDG-BB 4011777;ASISCHEM C63391;(2E)-3-[2-(ETHYLTHIO)PYRIMIDIN-5-YL]ACRYLIC ACID;(2E)-3-[2-(ethylthio)pyrimidin-5-yl]acrylic acid(SALTDATA: FREE)
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CAS No:
Computed Properties
Molecular Weight:210.26
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:210.04629874
Monoisotopic Mass:210.04629874
Topological Polar Surface Area:88.4
Heavy Atom Count:14
Complexity:213
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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