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24888-93-5 | 4-Pyrimidinamine, 6-methyl-2-(methylthio)-
CAS No: 24888-93-5 Catalog No: AG002PQQ MDL No:MFCD02091120
Product Description
Catalog Number:
AG002PQQ
Chemical Name:
4-Pyrimidinamine, 6-methyl-2-(methylthio)-
CAS Number:
24888-93-5
Molecular Formula:
C6H9N3S
Molecular Weight:
155.2208
MDL Number:
MFCD02091120
IUPAC Name:
6-methyl-2-methylsulfanylpyrimidin-4-amine
InChI:
InChI=1S/C6H9N3S/c1-4-3-5(7)9-6(8-4)10-2/h3H,1-2H3,(H2,7,8,9)
InChI Key:
VSWNFVWHRRUHMM-UHFFFAOYSA-N
SMILES:
CSc1nc(C)cc(n1)N
NSC Number:
227904
Properties
Complexity:
109
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.219g/mol
Monoisotopic Mass:
155.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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