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1193-74-4 | 2-Pyrimidinamine, 4,5-dimethyl-
CAS No: 1193-74-4 Catalog No: AG000IJU MDL No:MFCD00151982
Product Description
Catalog Number:
AG000IJU
Chemical Name:
2-Pyrimidinamine, 4,5-dimethyl-
CAS Number:
1193-74-4
Molecular Formula:
C6H9N3
Molecular Weight:
123.1558
MDL Number:
MFCD00151982
IUPAC Name:
4,5-dimethylpyrimidin-2-amine
InChI:
InChI=1S/C6H9N3/c1-4-3-8-6(7)9-5(4)2/h3H,1-2H3,(H2,7,8,9)
InChI Key:
IELZPOFKHRZRGS-UHFFFAOYSA-N
SMILES:
Nc1ncc(c(n1)C)C
NSC Number:
27188
Properties
Complexity:
94.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.08g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.159g/mol
Monoisotopic Mass:
123.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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