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Home > Nitro Compounds > 75423-19-7
75423-19-7 | 2-(Methylthio)-5-nitropyriMidin-4-ol
CAS No: 75423-19-7 Catalog No: AG00G5KC MDL No:
Product Description
Catalog Number:
AG00G5KC
Chemical Name:
2-(Methylthio)-5-nitropyriMidin-4-ol
CAS Number:
75423-19-7
IUPAC Name:
2-methylsulfanyl-5-nitro-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H5N3O3S/c1-12-5-6-2-3(8(10)11)4(9)7-5/h2H,1H3,(H,6,7,9)
InChI Key:
ZHQPCZZUXLSAAB-UHFFFAOYSA-N
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.005g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.173g/mol
Monoisotopic Mass:
187.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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