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24748-95-6 | 2-Pyrimidinamine, 5-[2-(4-bromophenyl)diazenyl]-4,6-dimethyl-
CAS No: 24748-95-6 Catalog No: AG002PAW MDL No:
Product Description
Catalog Number:
AG002PAW
Chemical Name:
2-Pyrimidinamine, 5-[2-(4-bromophenyl)diazenyl]-4,6-dimethyl-
CAS Number:
24748-95-6
Molecular Formula:
C12H12BrN5
Molecular Weight:
306.1612
IUPAC Name:
5-[(4-bromophenyl)diazenyl]-4,6-dimethylpyrimidin-2-amine
InChI:
InChI=1S/C12H12BrN5/c1-7-11(8(2)16-12(14)15-7)18-17-10-5-3-9(13)4-6-10/h3-6H,1-2H3,(H2,14,15,16)
InChI Key:
FPZAEQYEVHHLCO-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)N=Nc1c(C)nc(nc1C)N
NSC Number:
129174
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.028g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.167g/mol
Monoisotopic Mass:
305.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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