1-(4,5-dimethyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride

1-(4,5-dimethyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride

CAS: 1269053-76-0

Formula: C10H15Cl2N3

SMILES: Cl.Cl.CC1=CC=C2NC(CN)=NC2=C1C

IUPAC: 1-(4,5-dimethyl-1H-1,3-benzodiazol-2-yl)methanamine dihydrochloride

InChI: InChI=1S/C10H13N3.2ClH/c1-6-3-4-8-10(7(6)2)13-9(5-11)12-8;;/h3-4H,5,11H2,1-2H3,(H,12,13);2*1H

Composition: C (48.40%), H (6.09%), Cl (28.57%), N (16.93%)

Molar Mass: 248.15

Atom Count: 30

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	247.0643029
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	GJPLEGUJLLVNCQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.85
Topological Polar Surface Area	54.7
Polarizability	21.59
Ring Count	2
Rotatable Bond Count	1

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