2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride

C10H10ClFO3S — CID 87574652

IUPAC2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride
SMILESCOc1ccc(C2CC2S(=O)(=O)Cl)c(F)c1
InChIInChI=1S/C10H10ClFO3S/c1-15-6-2-3-7(9(12)4-6)8-5-10(8)16(11,13)14/h2-4,8,10H,5H2,1H3
InChIKeyWZKKTWLCKNFWEU-UHFFFAOYSA-N
MW264.71 g/mol
LogP2.26
Rot. Bonds3

About 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride

2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride (PubChem CID 87574652) has the molecular formula C10H10ClFO3S and a molecular weight of 264.71 g/mol. Its IUPAC name is 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride.

Molecular Properties

Compound Name2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride
PubChem CID87574652
Molecular FormulaC10H10ClFO3S
Molecular Weight264.71 g/mol
Exact Mass264.00
IUPAC Name2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride
SMILESCOc1ccc(C2CC2S(=O)(=O)Cl)c(F)c1
InChIInChI=1S/C10H10ClFO3S/c1-15-6-2-3-7(9(12)4-6)8-5-10(8)16(11,13)14/h2-4,8,10H,5H2,1H3
InChIKeyWZKKTWLCKNFWEU-UHFFFAOYSA-N
XLogP2.26
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.71
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride?
The IUPAC name of 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride (CID 87574652) is 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride.
What is the SMILES notation for 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride?
The canonical SMILES for 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride is COc1ccc(C2CC2S(=O)(=O)Cl)c(F)c1.
What is the InChIKey of 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride?
The InChIKey is WZKKTWLCKNFWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO3S/c1-15-6-2-3-7(9(12)4-6)8-5-10(8)16(11,13)14/h2-4,8,10H,5H2,1H3.
What are the key properties of 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride?
2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride has a molecular weight of 264.71 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-4-methoxyphenyl)cyclopropane-1-sulfonyl chloride is sourced from PubChem (CID 87574652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).