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1161763-15-0 | 4-Pyrimidinamine, 6-bromo-2-methyl-
CAS No: 1161763-15-0 Catalog No: AG000BTF MDL No:MFCD12923091
Product Description
Catalog Number:
AG000BTF
Chemical Name:
4-Pyrimidinamine, 6-bromo-2-methyl-
CAS Number:
1161763-15-0
Molecular Formula:
C5H6BrN3
Molecular Weight:
188.0252
MDL Number:
MFCD12923091
IUPAC Name:
6-bromo-2-methylpyrimidin-4-amine
InChI:
InChI=1S/C5H6BrN3/c1-3-8-4(6)2-5(7)9-3/h2H,1H3,(H2,7,8,9)
InChI Key:
AEWWKIWMCYZMJY-UHFFFAOYSA-N
SMILES:
Nc1cc(Br)nc(n1)C
Properties
Complexity:
98.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.975g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.028g/mol
Monoisotopic Mass:
186.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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