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1780-26-3 | Pyrimidine, 4,6-dichloro-2-methyl-
CAS No: 1780-26-3 Catalog No: AG0025Q0 MDL No:MFCD00090472
Product Description
Catalog Number:
AG0025Q0
Chemical Name:
Pyrimidine, 4,6-dichloro-2-methyl-
CAS Number:
1780-26-3
Molecular Formula:
C5H4Cl2N2
Molecular Weight:
163.0047
MDL Number:
MFCD00090472
IUPAC Name:
4,6-dichloro-2-methylpyrimidine
InChI:
InChI=1S/C5H4Cl2N2/c1-3-8-4(6)2-5(7)9-3/h2H,1H3
InChI Key:
FIMUTBLUWQGTIJ-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)nc(n1)C
NSC Number:
35923
Properties
Complexity:
89
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.975g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.001g/mol
Monoisotopic Mass:
161.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| 2-Methyl-4,6-bis-(1-methyl-hydrazino)pyrimidine. | Acta crystallographica. Section E, Structure reports online 20090701 |
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