2H-1-benzothiophen-3-one

2H-1-benzothiophen-3-one

CAS: 520-72-9

Formula: C8H6OS

SMILES: O=C1CSC2=CC=CC=C12

IUPAC: 2,3-dihydro-1-benzothiophen-3-one

InChI: InChI=1S/C8H6OS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-4H,5H2

Composition: C (63.98%), H (4.03%), O (10.65%), S (21.35%)

Molar Mass: 150.2

Atom Count: 16

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	150.013935987
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ADHAJDDBRUOZHJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.81
Topological Polar Surface Area	17.07
Polarizability	16.38
Ring Count	2
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	520-72-9		$133.71-$1,693.29$133.71$215.99$520.80$1,693.29