(2-methylcyclopropyl)methanesulfonyl fluoride

C5H9FO2S — CID 139022381

IUPAC(2-methylcyclopropyl)methanesulfonyl fluoride
SMILESCC1CC1CS(=O)(=O)F
InChIInChI=1S/C5H9FO2S/c1-4-2-5(4)3-9(6,7)8/h4-5H,2-3H2,1H3
InChIKeyULOQXZFLXHSCIW-UHFFFAOYSA-N
MW152.19 g/mol
LogP0.94
Rot. Bonds2

About (2-methylcyclopropyl)methanesulfonyl fluoride

(2-methylcyclopropyl)methanesulfonyl fluoride (PubChem CID 139022381) has the molecular formula C5H9FO2S and a molecular weight of 152.19 g/mol. Its IUPAC name is (2-methylcyclopropyl)methanesulfonyl fluoride.

Molecular Properties

Compound Name(2-methylcyclopropyl)methanesulfonyl fluoride
PubChem CID139022381
Molecular FormulaC5H9FO2S
Molecular Weight152.19 g/mol
Exact Mass152.03
IUPAC Name(2-methylcyclopropyl)methanesulfonyl fluoride
SMILESCC1CC1CS(=O)(=O)F
InChIInChI=1S/C5H9FO2S/c1-4-2-5(4)3-9(6,7)8/h4-5H,2-3H2,1H3
InChIKeyULOQXZFLXHSCIW-UHFFFAOYSA-N
XLogP0.94
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methylbutane-1-sulfonyl fluoride
CID 22935853
2-Methylpentane-1-sulfonyl fluoride
CID 54593061
2-Ethylcyclopropane-1-sulfonyl chloride
CID 55212029
2-Cyclopropylethane-1-sulfonyl chloride
CID 55279594
2-Methylpropane-1-sulfonyl fluoride
CID 56604709
Cyclopropylmethanesulfonyl fluoride
CID 115011326
2-Ethylbutane-1-sulfonyl fluoride
CID 54593062
2-Cyclopropyl-2-fluoroethane-1-sulfonyl chloride
CID 105442390
rac-((1R,2R)-2-(fluoromethyl)cyclopropyl)methanesulfonyl chloride
CID 137963782
(1-Methylcyclopropyl)methanesulfonyl fluoride
CID 138989246
5-Methylhexane-1-sulfonyl fluoride
CID 22935898
4-Methylpentane-1-sulfonyl fluoride
CID 22935901

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopropyl)methanesulfonyl fluoride?
The IUPAC name of (2-methylcyclopropyl)methanesulfonyl fluoride (CID 139022381) is (2-methylcyclopropyl)methanesulfonyl fluoride.
What is the SMILES notation for (2-methylcyclopropyl)methanesulfonyl fluoride?
The canonical SMILES for (2-methylcyclopropyl)methanesulfonyl fluoride is CC1CC1CS(=O)(=O)F.
What is the InChIKey of (2-methylcyclopropyl)methanesulfonyl fluoride?
The InChIKey is ULOQXZFLXHSCIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FO2S/c1-4-2-5(4)3-9(6,7)8/h4-5H,2-3H2,1H3.
What are the key properties of (2-methylcyclopropyl)methanesulfonyl fluoride?
(2-methylcyclopropyl)methanesulfonyl fluoride has a molecular weight of 152.19 g/mol, XLogP of 0.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopropyl)methanesulfonyl fluoride is sourced from PubChem (CID 139022381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).