2-(3-fluorocyclopentyl)ethanesulfonyl chloride

C7H12ClFO2S — CID 105468164

IUPAC2-(3-fluorocyclopentyl)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)CCC1CCC(F)C1
InChIInChI=1S/C7H12ClFO2S/c8-12(10,11)4-3-6-1-2-7(9)5-6/h6-7H,1-5H2
InChIKeyMOCFXWIKNGCTKJ-UHFFFAOYSA-N
MW214.69 g/mol
LogP2.08
Rot. Bonds3

About 2-(3-fluorocyclopentyl)ethanesulfonyl chloride

2-(3-fluorocyclopentyl)ethanesulfonyl chloride (PubChem CID 105468164) has the molecular formula C7H12ClFO2S and a molecular weight of 214.69 g/mol. Its IUPAC name is 2-(3-fluorocyclopentyl)ethanesulfonyl chloride.

Molecular Properties

Compound Name2-(3-fluorocyclopentyl)ethanesulfonyl chloride
PubChem CID105468164
Molecular FormulaC7H12ClFO2S
Molecular Weight214.69 g/mol
Exact Mass214.02
IUPAC Name2-(3-fluorocyclopentyl)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)CCC1CCC(F)C1
InChIInChI=1S/C7H12ClFO2S/c8-12(10,11)4-3-6-1-2-7(9)5-6/h6-7H,1-5H2
InChIKeyMOCFXWIKNGCTKJ-UHFFFAOYSA-N
XLogP2.08
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1S,3R)-3-fluorocyclopentyl]acetic acid
CID 105428900
2-[(1R,3R)-3-fluorocyclopentyl]acetic acid
CID 135389382
3-(2-methylsulfonylethyl)cyclopentan-1-ol
CID 64513199
2-[(2S)-oxolan-2-yl]ethanesulfonyl chloride
CID 98112256
2-(oxolan-2-yl)ethanesulfonyl chloride
CID 65158435
1-chloro-3-(2-methylsulfonylethyl)cycloheptane
CID 64507071
[2-[(1R,3S)-3-fluorocyclopentyl]-1-hydroxy-1-phosphonoethyl]phosphonic acid
CID 135389665
disodium;4-(2-sulfoethyl)cyclohexane-1,2-diolate
CID 141037717
(3-fluorocyclobutyl)methanesulfonamide
CID 126717840
3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol
CID 106732427
2-(cyclohexylmethylsulfonylamino)ethanesulfonyl chloride
CID 81357977
1-bromo-3-(2-propylsulfonylethyl)cyclopentane
CID 106732521

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorocyclopentyl)ethanesulfonyl chloride?
The IUPAC name of 2-(3-fluorocyclopentyl)ethanesulfonyl chloride (CID 105468164) is 2-(3-fluorocyclopentyl)ethanesulfonyl chloride.
What is the SMILES notation for 2-(3-fluorocyclopentyl)ethanesulfonyl chloride?
The canonical SMILES for 2-(3-fluorocyclopentyl)ethanesulfonyl chloride is O=S(=O)(Cl)CCC1CCC(F)C1.
What is the InChIKey of 2-(3-fluorocyclopentyl)ethanesulfonyl chloride?
The InChIKey is MOCFXWIKNGCTKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12ClFO2S/c8-12(10,11)4-3-6-1-2-7(9)5-6/h6-7H,1-5H2.
What are the key properties of 2-(3-fluorocyclopentyl)ethanesulfonyl chloride?
2-(3-fluorocyclopentyl)ethanesulfonyl chloride has a molecular weight of 214.69 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorocyclopentyl)ethanesulfonyl chloride is sourced from PubChem (CID 105468164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).