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2-(chloromethyl)-5-methylpyrimidine hydrochloride

2-(chloromethyl)-5-methylpyrimidine hydrochloride

CAS: 1384430-75-4

Formula: C6H8Cl2N2

SMILES: Cl.CC1=CN=C(CCl)N=C1

IUPAC: 2-(chloromethyl)-5-methylpyrimidine hydrochloride

InChI: InChI=1S/C6H7ClN2.ClH/c1-5-3-8-6(2-7)9-4-5;/h3-4H,2H2,1H3;1H

Composition: C (40.25%), H (4.50%), Cl (39.60%), N (15.65%)

Molar Mass: 179.04

Atom Count: 18

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 178.0064537
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey HTCRCIHHNQXFGF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.14
Topological Polar Surface Area 25.78
Polarizability 13.99
Ring Count 1
Rotatable Bond Count 1

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