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1-benzothiophene-2-sulfonyl chloride

1-benzothiophene-2-sulfonyl chloride

CAS: 90001-64-2

Formula: C8H5ClO2S2

SMILES: ClS(=O)(=O)C1=CC2=CC=CC=C2S1

IUPAC: 1-benzothiophene-2-sulfonyl chloride

InChI: InChI=1S/C8H5ClO2S2/c9-13(10,11)8-5-6-3-1-2-4-7(6)12-8/h1-5H

Composition: C (41.29%), H (2.17%), Cl (15.23%), O (13.75%), S (27.56%)

Molar Mass: 232.7

Atom Count: 18

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 231.9419494
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey FKIIVBOPAHICHQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.75
Topological Polar Surface Area 34.14
Polarizability 22.58
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 90001-64-2 $125.35-$234.60$125.35$234.60
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