amitifadine hydrochloride

amitifadine hydrochloride

CAS: 410074-74-7

Formula: C11H12Cl3N

SMILES: Cl[H].ClC1=CC=C(C=C1Cl)[C@@]12C[C@@H]1CNC2

IUPAC: (1R,5S)-1-(3,4-dichlorophenyl)-3-azabicyclo[3.1.0]hexane hydrochloride

InChI: InChI=1S/C11H11Cl2N.ClH/c12-9-2-1-7(3-10(9)13)11-4-8(11)5-14-6-11;/h1-3,8,14H,4-6H2;1H/t8-,11-;/m1./s1

Composition: C (49.94%), H (4.57%), Cl (40.20%), N (5.29%)

Molar Mass: 264.57

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	263.0035325
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KAGBHVBIOJBGBD-NINOIYOQSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.88
Topological Polar Surface Area	12.03
Polarizability	23.29
Ring Count	3
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99.86%	<7 Days	410074-74-7		$271.15-$1,019.15$271.15$458.15$1,019.15