2,4-dimethoxypyridine-3-sulfonyl chloride

C7H8ClNO4S — CID 23228200

IUPAC2,4-dimethoxypyridine-3-sulfonyl chloride
SMILESCOc1ccnc(OC)c1S(=O)(=O)Cl
InChIInChI=1S/C7H8ClNO4S/c1-12-5-3-4-9-7(13-2)6(5)14(8,10)11/h3-4H,1-2H3
InChIKeyOWZRNKPTVDTVKC-UHFFFAOYSA-N
MW237.66 g/mol
LogP1.03
Rot. Bonds3

About 2,4-dimethoxypyridine-3-sulfonyl chloride

2,4-dimethoxypyridine-3-sulfonyl chloride (PubChem CID 23228200) has the molecular formula C7H8ClNO4S and a molecular weight of 237.66 g/mol. Its IUPAC name is 2,4-dimethoxypyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2,4-dimethoxypyridine-3-sulfonyl chloride
PubChem CID23228200
Molecular FormulaC7H8ClNO4S
Molecular Weight237.66 g/mol
Exact Mass236.99
IUPAC Name2,4-dimethoxypyridine-3-sulfonyl chloride
SMILESCOc1ccnc(OC)c1S(=O)(=O)Cl
InChIInChI=1S/C7H8ClNO4S/c1-12-5-3-4-9-7(13-2)6(5)14(8,10)11/h3-4H,1-2H3
InChIKeyOWZRNKPTVDTVKC-UHFFFAOYSA-N
XLogP1.03
TPSA65.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxypyridine-3-sulfonyl chloride?
The IUPAC name of 2,4-dimethoxypyridine-3-sulfonyl chloride (CID 23228200) is 2,4-dimethoxypyridine-3-sulfonyl chloride.
What is the SMILES notation for 2,4-dimethoxypyridine-3-sulfonyl chloride?
The canonical SMILES for 2,4-dimethoxypyridine-3-sulfonyl chloride is COc1ccnc(OC)c1S(=O)(=O)Cl.
What is the InChIKey of 2,4-dimethoxypyridine-3-sulfonyl chloride?
The InChIKey is OWZRNKPTVDTVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO4S/c1-12-5-3-4-9-7(13-2)6(5)14(8,10)11/h3-4H,1-2H3.
What are the key properties of 2,4-dimethoxypyridine-3-sulfonyl chloride?
2,4-dimethoxypyridine-3-sulfonyl chloride has a molecular weight of 237.66 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxypyridine-3-sulfonyl chloride is sourced from PubChem (CID 23228200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).