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1-[3-(1H-imidazol-2-yl)phenyl]methanamine dihydrochloride

1-[3-(1H-imidazol-2-yl)phenyl]methanamine dihydrochloride

CAS: 1432679-81-6

Formula: C10H13Cl2N3

SMILES: Cl.Cl.NCC1=CC=CC(=C1)C1=NC=CN1

IUPAC: 1-[3-(1H-imidazol-2-yl)phenyl]methanamine dihydrochloride

InChI: InChI=1S/C10H11N3.2ClH/c11-7-8-2-1-3-9(6-8)10-12-4-5-13-10;;/h1-6H,7,11H2,(H,12,13);2*1H

Composition: C (48.80%), H (5.32%), Cl (28.81%), N (17.07%)

Molar Mass: 246.14

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 245.0486528
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey GUQHZURIOOYJMD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.59
Topological Polar Surface Area 54.7
Polarizability 20.81
Ring Count 2
Rotatable Bond Count 2

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