4-chloro-2-methylquinoline-8-sulfonyl chloride

C10H7Cl2NO2S — CID 25217462

IUPAC4-chloro-2-methylquinoline-8-sulfonyl chloride
SMILESCc1cc(Cl)c2cccc(S(=O)(=O)Cl)c2n1
InChIInChI=1S/C10H7Cl2NO2S/c1-6-5-8(11)7-3-2-4-9(10(7)13-6)16(12,14)15/h2-5H,1H3
InChIKeyGYHCPIZEUGCWNH-UHFFFAOYSA-N
MW276.14 g/mol
LogP3.12
Rot. Bonds1

About 4-chloro-2-methylquinoline-8-sulfonyl chloride

4-chloro-2-methylquinoline-8-sulfonyl chloride (PubChem CID 25217462) has the molecular formula C10H7Cl2NO2S and a molecular weight of 276.14 g/mol. Its IUPAC name is 4-chloro-2-methylquinoline-8-sulfonyl chloride.

Molecular Properties

Compound Name4-chloro-2-methylquinoline-8-sulfonyl chloride
PubChem CID25217462
Molecular FormulaC10H7Cl2NO2S
Molecular Weight276.14 g/mol
Exact Mass274.96
IUPAC Name4-chloro-2-methylquinoline-8-sulfonyl chloride
SMILESCc1cc(Cl)c2cccc(S(=O)(=O)Cl)c2n1
InChIInChI=1S/C10H7Cl2NO2S/c1-6-5-8(11)7-3-2-4-9(10(7)13-6)16(12,14)15/h2-5H,1H3
InChIKeyGYHCPIZEUGCWNH-UHFFFAOYSA-N
XLogP3.12
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.14
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methylquinoline-8-sulfonyl chloride?
The IUPAC name of 4-chloro-2-methylquinoline-8-sulfonyl chloride (CID 25217462) is 4-chloro-2-methylquinoline-8-sulfonyl chloride.
What is the SMILES notation for 4-chloro-2-methylquinoline-8-sulfonyl chloride?
The canonical SMILES for 4-chloro-2-methylquinoline-8-sulfonyl chloride is Cc1cc(Cl)c2cccc(S(=O)(=O)Cl)c2n1.
What is the InChIKey of 4-chloro-2-methylquinoline-8-sulfonyl chloride?
The InChIKey is GYHCPIZEUGCWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2NO2S/c1-6-5-8(11)7-3-2-4-9(10(7)13-6)16(12,14)15/h2-5H,1H3.
What are the key properties of 4-chloro-2-methylquinoline-8-sulfonyl chloride?
4-chloro-2-methylquinoline-8-sulfonyl chloride has a molecular weight of 276.14 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methylquinoline-8-sulfonyl chloride is sourced from PubChem (CID 25217462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).