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84928-85-8 | 4-Pyrimidinamine, 2-(methylthio)-5-nitro-
CAS No: 84928-85-8 Catalog No: AG01FMA5 MDL No:
Product Description
Catalog Number:
AG01FMA5
Chemical Name:
4-Pyrimidinamine, 2-(methylthio)-5-nitro-
CAS Number:
84928-85-8
IUPAC Name:
2-methylsulfanyl-5-nitropyrimidin-4-amine
InChI:
InChI=1S/C5H6N4O2S/c1-12-5-7-2-3(9(10)11)4(6)8-5/h2H,1H3,(H2,6,7,8)
InChI Key:
DRKQXDCCGQYDER-UHFFFAOYSA-N
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.021g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.189g/mol
Monoisotopic Mass:
186.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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