1-benzothiophene-7-carbonyl chloride

1-benzothiophene-7-carbonyl chloride

CAS: 120081-47-2

Formula: C9H5ClOS

SMILES: ClC(=O)C1=C2SC=CC2=CC=C1

IUPAC: 1-benzothiophene-7-carbonyl chloride

InChI: InChI=1S/C9H5ClOS/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-5H

Composition: C (54.97%), H (2.56%), Cl (18.03%), O (8.14%), S (16.30%)

Molar Mass: 196.65

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	195.9749637
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	JILFWFGWWHGBHQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.51
Topological Polar Surface Area	17.07
Polarizability	20.24
Ring Count	2
Rotatable Bond Count	1

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