(1-fluorocyclobutyl)methanesulfonyl chloride

C5H8ClFO2S — CID 119031264

IUPAC(1-fluorocyclobutyl)methanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1(F)CCC1
InChIInChI=1S/C5H8ClFO2S/c6-10(8,9)4-5(7)2-1-3-5/h1-4H2
InChIKeyCVZWKGMVXFJMNE-UHFFFAOYSA-N
MW186.63 g/mol
LogP1.45
Rot. Bonds2

About (1-fluorocyclobutyl)methanesulfonyl chloride

(1-fluorocyclobutyl)methanesulfonyl chloride (PubChem CID 119031264) has the molecular formula C5H8ClFO2S and a molecular weight of 186.63 g/mol. Its IUPAC name is (1-fluorocyclobutyl)methanesulfonyl chloride.

Molecular Properties

Compound Name(1-fluorocyclobutyl)methanesulfonyl chloride
PubChem CID119031264
Molecular FormulaC5H8ClFO2S
Molecular Weight186.63 g/mol
Exact Mass185.99
IUPAC Name(1-fluorocyclobutyl)methanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1(F)CCC1
InChIInChI=1S/C5H8ClFO2S/c6-10(8,9)4-5(7)2-1-3-5/h1-4H2
InChIKeyCVZWKGMVXFJMNE-UHFFFAOYSA-N
XLogP1.45
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.63
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Fluorocyclobutane-1-sulfonyl chloride
CID 55263297
Cyclobutylmethanesulfonyl chloride
CID 55280140
(3,3-Difluorocyclobutyl)methanesulfonyl chloride
CID 90355675
3-Methylcyclobutane-1-sulfonyl chloride
CID 103564836
3-(Difluoromethyl)cyclobutane-1-sulfonyl chloride
CID 118868806
(3-Fluorocyclobutyl)methanesulfonyl chloride
CID 126688657
(3-Fluoro-3-methylcyclobutyl)methanesulfonyl chloride
CID 177183782
5-Fluoropentane-1-sulfonyl chloride
CID 3029710
3-(Trifluoromethyl)cyclobutane-1-sulfonyl chloride
CID 131196495
[3-(Trifluoromethyl)cyclobutyl]methanesulfonyl chloride
CID 138987509
3-(Fluoromethyl)cyclobutane-1-sulfonyl chloride
CID 165947738
(1-Fluoro-3-methylcyclobutyl)methanesulfonyl chloride
CID 167729412

Frequently Asked Questions

What is the IUPAC name of (1-fluorocyclobutyl)methanesulfonyl chloride?
The IUPAC name of (1-fluorocyclobutyl)methanesulfonyl chloride (CID 119031264) is (1-fluorocyclobutyl)methanesulfonyl chloride.
What is the SMILES notation for (1-fluorocyclobutyl)methanesulfonyl chloride?
The canonical SMILES for (1-fluorocyclobutyl)methanesulfonyl chloride is O=S(=O)(Cl)CC1(F)CCC1.
What is the InChIKey of (1-fluorocyclobutyl)methanesulfonyl chloride?
The InChIKey is CVZWKGMVXFJMNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8ClFO2S/c6-10(8,9)4-5(7)2-1-3-5/h1-4H2.
What are the key properties of (1-fluorocyclobutyl)methanesulfonyl chloride?
(1-fluorocyclobutyl)methanesulfonyl chloride has a molecular weight of 186.63 g/mol, XLogP of 1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-fluorocyclobutyl)methanesulfonyl chloride is sourced from PubChem (CID 119031264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).