cyclopentylmethanesulfonyl chloride

C6H11ClO2S — CID 2735404

IUPACcyclopentylmethanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1CCCC1
InChIInChI=1S/C6H11ClO2S/c7-10(8,9)5-6-3-1-2-4-6/h6H,1-5H2
InChIKeyFKELTSTWLHPFMJ-UHFFFAOYSA-N
MW182.67 g/mol
LogP1.75
Rot. Bonds2

About cyclopentylmethanesulfonyl chloride

cyclopentylmethanesulfonyl chloride (PubChem CID 2735404) has the molecular formula C6H11ClO2S and a molecular weight of 182.67 g/mol. Its IUPAC name is cyclopentylmethanesulfonyl chloride.

Molecular Properties

Compound Namecyclopentylmethanesulfonyl chloride
PubChem CID2735404
Molecular FormulaC6H11ClO2S
Molecular Weight182.67 g/mol
Exact Mass182.02
IUPAC Namecyclopentylmethanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1CCCC1
InChIInChI=1S/C6H11ClO2S/c7-10(8,9)5-6-3-1-2-4-6/h6H,1-5H2
InChIKeyFKELTSTWLHPFMJ-UHFFFAOYSA-N
XLogP1.75
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.67
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentylmethanesulfonyl chloride?
The IUPAC name of cyclopentylmethanesulfonyl chloride (CID 2735404) is cyclopentylmethanesulfonyl chloride.
What is the SMILES notation for cyclopentylmethanesulfonyl chloride?
The canonical SMILES for cyclopentylmethanesulfonyl chloride is O=S(=O)(Cl)CC1CCCC1.
What is the InChIKey of cyclopentylmethanesulfonyl chloride?
The InChIKey is FKELTSTWLHPFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11ClO2S/c7-10(8,9)5-6-3-1-2-4-6/h6H,1-5H2.
What are the key properties of cyclopentylmethanesulfonyl chloride?
cyclopentylmethanesulfonyl chloride has a molecular weight of 182.67 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethanesulfonyl chloride is sourced from PubChem (CID 2735404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).