methyl[2-(4-methyl-1H-1,3-benzodiazol-2-yl)ethyl]amine hydrochloride

methyl[2-(4-methyl-1H-1,3-benzodiazol-2-yl)ethyl]amine hydrochloride

CAS: 1185447-69-1

Formula: C11H16ClN3

SMILES: Cl.CNCCC1=NC2=C(C)C=CC=C2N1

IUPAC: methyl[2-(4-methyl-1H-1,3-benzodiazol-2-yl)ethyl]amine hydrochloride

InChI: InChI=1S/C11H15N3.ClH/c1-8-4-3-5-9-11(8)14-10(13-9)6-7-12-2;/h3-5,12H,6-7H2,1-2H3,(H,13,14);1H

Composition: C (58.53%), H (7.15%), Cl (15.71%), N (18.62%)

Molar Mass: 225.72

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	225.1032752
Formal Charge	0
FSP3	0.36
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NVICJRSLRMLPLI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.28
Topological Polar Surface Area	40.71
Polarizability	23.44
Ring Count	2
Rotatable Bond Count	3

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95%	<4 Days	1185447-69-1		$28.75-$1,189.10$28.75$116.15$234.60$1,189.10