1-(5-fluoro-1-benzothiophen-2-yl)methanamine hydrochloride

1-(5-fluoro-1-benzothiophen-2-yl)methanamine hydrochloride

CAS: 55810-76-9

Formula: C9H9ClFNS

SMILES: Cl.NCC1=CC2=CC(F)=CC=C2S1

IUPAC: 1-(5-fluoro-1-benzothiophen-2-yl)methanamine hydrochloride

InChI: InChI=1S/C9H8FNS.ClH/c10-7-1-2-9-6(3-7)4-8(5-11)12-9;/h1-4H,5,11H2;1H

Composition: C (49.66%), H (4.17%), Cl (16.28%), F (8.73%), N (6.43%), S (14.73%)

Molar Mass: 217.69

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	217.0128263
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PQGVKSGPPAIUIC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.87
Topological Polar Surface Area	26.02
Polarizability	19.5
Ring Count	2
Rotatable Bond Count	1

Suppliers

Key Organics Ltd

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	55810-76-9		$51.35-$753.83$51.35$63.37$86.31$563.73$753.83