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15579-63-2

15579-63-2 | 4,5-Pyrimidinediamine, 2-methyl-

CAS No: 15579-63-2 Catalog No: AG001O6W MDL No:

Product Description

Catalog Number:
AG001O6W
Chemical Name:
4,5-Pyrimidinediamine, 2-methyl-
CAS Number:
15579-63-2
Molecular Formula:
C5H8N4
Molecular Weight:
124.1438
IUPAC Name:
2-methylpyrimidine-4,5-diamine
InChI:
InChI=1S/C5H8N4/c1-3-8-2-4(6)5(7)9-3/h2H,6H2,1H3,(H2,7,8,9)
InChI Key:
NUCHSOWNRSBTJL-UHFFFAOYSA-N
SMILES:
Cc1ncc(c(n1)N)N

Properties

Complexity:
95  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.075g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
124.147g/mol
Monoisotopic Mass:
124.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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