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2,4-dichloro-5-(chloromethyl)-6-methylpyrimidine

2,4-dichloro-5-(chloromethyl)-6-methylpyrimidine

CAS: 16768-43-7

Formula: C6H5Cl3N2

SMILES: CC1=C(CCl)C(Cl)=NC(Cl)=N1

IUPAC: 2,4-dichloro-5-(chloromethyl)-6-methylpyrimidine

InChI: InChI=1S/C6H5Cl3N2/c1-3-4(2-7)5(8)11-6(9)10-3/h2H2,1H3

Composition: C (34.08%), H (2.38%), Cl (50.29%), N (13.25%)

Molar Mass: 211.47

Atom Count: 16

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 209.9518313
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey XPHHRYQLVDQYDR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.55
Topological Polar Surface Area 25.78
Polarizability 18.07
Ring Count 1
Rotatable Bond Count 1

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