2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride

C10H6Cl2O2S2 — CID 82307876

IUPAC2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(-c2cccs2)ccc1Cl
InChIInChI=1S/C10H6Cl2O2S2/c11-8-4-3-7(9-2-1-5-15-9)6-10(8)16(12,13)14/h1-6H
InChIKeyIYEUUFPNMPYGCF-UHFFFAOYSA-N
MW293.20 g/mol
LogP4.00
Rot. Bonds2

About 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride

2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride (PubChem CID 82307876) has the molecular formula C10H6Cl2O2S2 and a molecular weight of 293.20 g/mol. Its IUPAC name is 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride.

Molecular Properties

Compound Name2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride
PubChem CID82307876
Molecular FormulaC10H6Cl2O2S2
Molecular Weight293.20 g/mol
Exact Mass291.92
IUPAC Name2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(-c2cccs2)ccc1Cl
InChIInChI=1S/C10H6Cl2O2S2/c11-8-4-3-7(9-2-1-5-15-9)6-10(8)16(12,13)14/h1-6H
InChIKeyIYEUUFPNMPYGCF-UHFFFAOYSA-N
XLogP4.00
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.20
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride?
The IUPAC name of 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride (CID 82307876) is 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride.
What is the SMILES notation for 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride?
The canonical SMILES for 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride is O=S(=O)(Cl)c1cc(-c2cccs2)ccc1Cl.
What is the InChIKey of 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride?
The InChIKey is IYEUUFPNMPYGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2O2S2/c11-8-4-3-7(9-2-1-5-15-9)6-10(8)16(12,13)14/h1-6H.
What are the key properties of 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride?
2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride has a molecular weight of 293.20 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-thiophen-2-ylbenzenesulfonyl chloride is sourced from PubChem (CID 82307876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).