2-methylcyclopropane-1-sulfonyl fluoride

C4H7FO2S — CID 139363295

IUPAC2-methylcyclopropane-1-sulfonyl fluoride
SMILESCC1CC1S(=O)(=O)F
InChIInChI=1S/C4H7FO2S/c1-3-2-4(3)8(5,6)7/h3-4H,2H2,1H3
InChIKeyUZRCXARWTMRHJW-UHFFFAOYSA-N
MW138.16 g/mol
LogP0.69
Rot. Bonds1

About 2-methylcyclopropane-1-sulfonyl fluoride

2-methylcyclopropane-1-sulfonyl fluoride (PubChem CID 139363295) has the molecular formula C4H7FO2S and a molecular weight of 138.16 g/mol. Its IUPAC name is 2-methylcyclopropane-1-sulfonyl fluoride.

Molecular Properties

Compound Name2-methylcyclopropane-1-sulfonyl fluoride
PubChem CID139363295
Molecular FormulaC4H7FO2S
Molecular Weight138.16 g/mol
Exact Mass138.02
IUPAC Name2-methylcyclopropane-1-sulfonyl fluoride
SMILESCC1CC1S(=O)(=O)F
InChIInChI=1S/C4H7FO2S/c1-3-2-4(3)8(5,6)7/h3-4H,2H2,1H3
InChIKeyUZRCXARWTMRHJW-UHFFFAOYSA-N
XLogP0.69
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.16
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclopropylmethanesulphonyl chloride
CID 14106996
2-Methylbutane-1-sulfonyl fluoride
CID 22935853
2-Methylpropane-1-sulfonyl fluoride
CID 56604709
Cyclopropylmethanesulfonyl fluoride
CID 115011326
rac-(1R,2R)-2-methylcyclopropane-1-sulfonyl chloride
CID 138987616
(1-Methylcyclopropyl)methanesulfonyl fluoride
CID 138989246
(2-Methylcyclopropyl)methanesulfonyl fluoride
CID 139022381
3-Methylbutane-1-sulfonyl fluoride
CID 87773919
2,2-Dimethylcyclopropane-1-sulfonyl fluoride
CID 139363293
Fluoro 2-methylpropane-1-sulfonate
CID 140545366
1-Methylcyclopropane-1-sulfonyl fluoride
CID 162341526
(2R)-2-methylbutane-1-sulfonyl fluoride
CID 98124569

Frequently Asked Questions

What is the IUPAC name of 2-methylcyclopropane-1-sulfonyl fluoride?
The IUPAC name of 2-methylcyclopropane-1-sulfonyl fluoride (CID 139363295) is 2-methylcyclopropane-1-sulfonyl fluoride.
What is the SMILES notation for 2-methylcyclopropane-1-sulfonyl fluoride?
The canonical SMILES for 2-methylcyclopropane-1-sulfonyl fluoride is CC1CC1S(=O)(=O)F.
What is the InChIKey of 2-methylcyclopropane-1-sulfonyl fluoride?
The InChIKey is UZRCXARWTMRHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7FO2S/c1-3-2-4(3)8(5,6)7/h3-4H,2H2,1H3.
What are the key properties of 2-methylcyclopropane-1-sulfonyl fluoride?
2-methylcyclopropane-1-sulfonyl fluoride has a molecular weight of 138.16 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylcyclopropane-1-sulfonyl fluoride is sourced from PubChem (CID 139363295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).