2-prop-2-enylsulfanyl-1H-pyrimidin-6-one
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2-prop-2-enylsulfanyl-1H-pyrimidin-6-one
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CAS No:
31170-22-6
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Formula:
C7H8N2OS
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Chemical Name:
2-prop-2-enylsulfanyl-1H-pyrimidin-6-one
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Synonyms:
2-(allylsulfanyl)-4(3H)-pyrimidinone;31170-22-6;NSC165462;MLS000705060;SCHEMBL1110848;SCHEMBL8194267;CHEMBL1718671;2-allylthiopyrimidin-4(3h)-one;DTXSID20304335;HMS2530B20;ZINC8684318;AKOS024343297;2-ALLYLSULFANYL-PYRIMIDIN-4-OL;MCULE-3612520082;NSC-165462;SMR000230982;4(3H)-Pyrimidinone, 2-(2-propen-1-ylthio)-;AI-204/31716046;2-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyrimidin-4-one
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CAS No:
2-prop-2-enylsulfanyl-1H-pyrimidin-6-one Basic Attributes
168.22 g/mol
168.03573406 g/mol
165462
DTXSID20304335
Computed Properties
Molecular Weight:168.22
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:168.03573406
Monoisotopic Mass:168.03573406
Topological Polar Surface Area:66.8
Heavy Atom Count:11
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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