1-(4-methyl-1,3-benzoxazol-2-yl)methanamine hydrochloride

1-(4-methyl-1,3-benzoxazol-2-yl)methanamine hydrochloride

CAS: 1255717-38-4

Formula: C9H11ClN2O

SMILES: Cl.CC1=C2N=C(CN)OC2=CC=C1

IUPAC: 1-(4-methyl-1,3-benzoxazol-2-yl)methanamine hydrochloride

InChI: InChI=1S/C9H10N2O.ClH/c1-6-3-2-4-7-9(6)11-8(5-10)12-7;/h2-4H,5,10H2,1H3;1H

Composition: C (54.42%), H (5.58%), Cl (17.85%), N (14.10%), O (8.05%)

Molar Mass: 198.65

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	198.0559907
Formal Charge	0
FSP3	0.22
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YTOLTKHXGDOCSP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.56
Topological Polar Surface Area	52.05
Polarizability	18.97
Ring Count	2
Rotatable Bond Count	1

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95%	<4 Days	1255717-38-4		$80.50-$1,550.20$80.50$151.80$378.35$645.15$1,550.20