2-fluoropropane-1-sulfonyl chloride

C3H6ClFO2S — CID 55263295

IUPAC2-fluoropropane-1-sulfonyl chloride
SMILESCC(F)CS(=O)(=O)Cl
InChIInChI=1S/C3H6ClFO2S/c1-3(5)2-8(4,6)7/h3H,2H2,1H3
InChIKeyXSPTVLLUSZGIRW-UHFFFAOYSA-N
MW160.60 g/mol
LogP0.91
Rot. Bonds2

About 2-fluoropropane-1-sulfonyl chloride

2-fluoropropane-1-sulfonyl chloride (PubChem CID 55263295) has the molecular formula C3H6ClFO2S and a molecular weight of 160.60 g/mol. Its IUPAC name is 2-fluoropropane-1-sulfonyl chloride.

Molecular Properties

Compound Name2-fluoropropane-1-sulfonyl chloride
PubChem CID55263295
Molecular FormulaC3H6ClFO2S
Molecular Weight160.60 g/mol
Exact Mass159.98
IUPAC Name2-fluoropropane-1-sulfonyl chloride
SMILESCC(F)CS(=O)(=O)Cl
InChIInChI=1S/C3H6ClFO2S/c1-3(5)2-8(4,6)7/h3H,2H2,1H3
InChIKeyXSPTVLLUSZGIRW-UHFFFAOYSA-N
XLogP0.91
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.60
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Ethanesulfonyl chloride
CID 11667
2-Propanesulfonyl chloride
CID 82408
1-Propanesulfonyl chloride
CID 66279
Butanesulfonyl chloride, 4-fluoro-
CID 9739
Ethanesulfonyl chloride, 2-fluoro-
CID 69806
3-Fluoropropane-1-sulfonyl chloride
CID 21114841
3,3,3-Trifluoropropane-1-sulfonyl chloride
CID 2761177
Propane-1-sulfonyl fluoride
CID 13721938
1-Fluoroethane-1-sulfonyl chloride
CID 23163370
3,3-Difluoropropane-1-sulfonyl chloride
CID 55263296
1,1,1-Trifluoropropane-2-sulfonyl chloride
CID 73994686
2,2-Difluoropropane-1-sulfonyl chloride
CID 84656710

Frequently Asked Questions

What is the IUPAC name of 2-fluoropropane-1-sulfonyl chloride?
The IUPAC name of 2-fluoropropane-1-sulfonyl chloride (CID 55263295) is 2-fluoropropane-1-sulfonyl chloride.
What is the SMILES notation for 2-fluoropropane-1-sulfonyl chloride?
The canonical SMILES for 2-fluoropropane-1-sulfonyl chloride is CC(F)CS(=O)(=O)Cl.
What is the InChIKey of 2-fluoropropane-1-sulfonyl chloride?
The InChIKey is XSPTVLLUSZGIRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6ClFO2S/c1-3(5)2-8(4,6)7/h3H,2H2,1H3.
What are the key properties of 2-fluoropropane-1-sulfonyl chloride?
2-fluoropropane-1-sulfonyl chloride has a molecular weight of 160.60 g/mol, XLogP of 0.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoropropane-1-sulfonyl chloride is sourced from PubChem (CID 55263295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).