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5-(chloromethyl)pyrimidin-2-amine hydrochloride

5-(chloromethyl)pyrimidin-2-amine hydrochloride

CAS: 120747-86-6

Formula: C5H7Cl2N3

SMILES: Cl.NC1=NC=C(CCl)C=N1

IUPAC: 5-(chloromethyl)pyrimidin-2-amine hydrochloride

InChI: InChI=1S/C5H6ClN3.ClH/c6-1-4-2-8-5(7)9-3-4;/h2-3H,1H2,(H2,7,8,9);1H

Composition: C (33.36%), H (3.92%), Cl (39.38%), N (23.34%)

Molar Mass: 180.03

Atom Count: 17

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 179.0017026
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HZCDXBZHIFMCGF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.24
Topological Polar Surface Area 51.8
Polarizability 13.39
Ring Count 1
Rotatable Bond Count 1

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