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5-fluoro-1-benzothiophene-2-carbonyl chloride

5-fluoro-1-benzothiophene-2-carbonyl chloride

CAS: 1190198-22-1

Formula: C9H4ClFOS

SMILES: FC1=CC=C2SC(=CC2=C1)C(Cl)=O

IUPAC: 5-fluoro-1-benzothiophene-2-carbonyl chloride

InChI: InChI=1S/C9H4ClFOS/c10-9(12)8-4-5-3-6(11)1-2-7(5)13-8/h1-4H

Composition: C (50.36%), H (1.88%), Cl (16.52%), F (8.85%), O (7.45%), S (14.94%)

Molar Mass: 214.64

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 213.9655418
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey ZKGYNEVYYSCZJA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.51
Topological Polar Surface Area 17.07
Polarizability 19.97
Ring Count 2
Rotatable Bond Count 1

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1190198-22-1 $51.35-$449.02$51.35$63.37$86.31$292.79$449.02
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