8-methylquinoline-3-sulfonyl chloride

C10H8ClNO2S — CID 130417856

IUPAC8-methylquinoline-3-sulfonyl chloride
SMILESCc1cccc2cc(S(=O)(=O)Cl)cnc12
InChIInChI=1S/C10H8ClNO2S/c1-7-3-2-4-8-5-9(15(11,13)14)6-12-10(7)8/h2-6H,1H3
InChIKeyTVQVJBMUDJXAFT-UHFFFAOYSA-N
MW241.70 g/mol
LogP2.47
Rot. Bonds1

About 8-methylquinoline-3-sulfonyl chloride

8-methylquinoline-3-sulfonyl chloride (PubChem CID 130417856) has the molecular formula C10H8ClNO2S and a molecular weight of 241.70 g/mol. Its IUPAC name is 8-methylquinoline-3-sulfonyl chloride.

Molecular Properties

Compound Name8-methylquinoline-3-sulfonyl chloride
PubChem CID130417856
Molecular FormulaC10H8ClNO2S
Molecular Weight241.70 g/mol
Exact Mass241.00
IUPAC Name8-methylquinoline-3-sulfonyl chloride
SMILESCc1cccc2cc(S(=O)(=O)Cl)cnc12
InChIInChI=1S/C10H8ClNO2S/c1-7-3-2-4-8-5-9(15(11,13)14)6-12-10(7)8/h2-6H,1H3
InChIKeyTVQVJBMUDJXAFT-UHFFFAOYSA-N
XLogP2.47
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.70
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methylquinoline-3-sulfonyl chloride?
The IUPAC name of 8-methylquinoline-3-sulfonyl chloride (CID 130417856) is 8-methylquinoline-3-sulfonyl chloride.
What is the SMILES notation for 8-methylquinoline-3-sulfonyl chloride?
The canonical SMILES for 8-methylquinoline-3-sulfonyl chloride is Cc1cccc2cc(S(=O)(=O)Cl)cnc12.
What is the InChIKey of 8-methylquinoline-3-sulfonyl chloride?
The InChIKey is TVQVJBMUDJXAFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO2S/c1-7-3-2-4-8-5-9(15(11,13)14)6-12-10(7)8/h2-6H,1H3.
What are the key properties of 8-methylquinoline-3-sulfonyl chloride?
8-methylquinoline-3-sulfonyl chloride has a molecular weight of 241.70 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylquinoline-3-sulfonyl chloride is sourced from PubChem (CID 130417856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).