benzyl(2,2,2-trifluoroethyl)amine hydrochloride

benzyl(2,2,2-trifluoroethyl)amine hydrochloride

CAS: 405878-98-0

Formula: C9H11ClF3N

SMILES: Cl[H].FC(F)(F)CNCC1=CC=CC=C1

IUPAC: benzyl(2,2,2-trifluoroethyl)amine hydrochloride

InChI: InChI=1S/C9H10F3N.ClH/c10-9(11,12)7-13-6-8-4-2-1-3-5-8;/h1-5,13H,6-7H2;1H

Composition: C (47.91%), H (4.91%), Cl (15.71%), F (25.26%), N (6.21%)

Molar Mass: 225.64

Atom Count: 25

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	225.0532115
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	GOZGAFVDXDYLRF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.76
Topological Polar Surface Area	12.03
Polarizability	16.61
Ring Count	1
Rotatable Bond Count	4

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97%	<7 Days	405878-98-0		$138.24-$311.04$138.24$207.36$311.04