1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanamine hydrochloride

1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanamine hydrochloride

CAS: 1172854-26-0

Formula: C10H12ClN3O

SMILES: Cl.CC1=CC=C(C=C1)C1=NC(CN)=NO1

IUPAC: 1-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methanamine hydrochloride

InChI: InChI=1S/C10H11N3O.ClH/c1-7-2-4-8(5-3-7)10-12-9(6-11)13-14-10;/h2-5H,6,11H2,1H3;1H

Composition: C (53.22%), H (5.36%), Cl (15.71%), N (18.62%), O (7.09%)

Molar Mass: 225.68

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	225.0668897
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	VMWUFXZSSCHTHD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.8
Topological Polar Surface Area	64.94
Polarizability	20.84
Ring Count	2
Rotatable Bond Count	2

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95%	<2 Days	1172854-26-0		$320.85-$494.11$320.85$494.11