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28969-57-5 | 4-Pyrimidinamine, 5,6-dichloro-2-methyl-
CAS No: 28969-57-5 Catalog No: AG002V1E MDL No:MFCD12405316
Product Description
Catalog Number:
AG002V1E
Chemical Name:
4-Pyrimidinamine, 5,6-dichloro-2-methyl-
CAS Number:
28969-57-5
Molecular Formula:
C5H5Cl2N3
Molecular Weight:
178.0193
MDL Number:
MFCD12405316
IUPAC Name:
5,6-dichloro-2-methylpyrimidin-4-amine
InChI:
InChI=1S/C5H5Cl2N3/c1-2-9-4(7)3(6)5(8)10-2/h1H3,(H2,8,9,10)
InChI Key:
DWKJHNLPCPQZBQ-UHFFFAOYSA-N
SMILES:
Cc1nc(N)c(c(n1)Cl)Cl
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.986g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.016g/mol
Monoisotopic Mass:
176.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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