furan-3-ylmethanesulfonyl fluoride

C5H5FO3S — CID 165483792

IUPACfuran-3-ylmethanesulfonyl fluoride
SMILESO=S(=O)(F)Cc1ccoc1
InChIInChI=1S/C5H5FO3S/c6-10(7,8)4-5-1-2-9-3-5/h1-3H,4H2
InChIKeyMCZURKGCDCWMNS-UHFFFAOYSA-N
MW164.16 g/mol
LogP1.08
Rot. Bonds2

About furan-3-ylmethanesulfonyl fluoride

furan-3-ylmethanesulfonyl fluoride (PubChem CID 165483792) has the molecular formula C5H5FO3S and a molecular weight of 164.16 g/mol. Its IUPAC name is furan-3-ylmethanesulfonyl fluoride.

Molecular Properties

Compound Namefuran-3-ylmethanesulfonyl fluoride
PubChem CID165483792
Molecular FormulaC5H5FO3S
Molecular Weight164.16 g/mol
Exact Mass163.99
IUPAC Namefuran-3-ylmethanesulfonyl fluoride
SMILESO=S(=O)(F)Cc1ccoc1
InChIInChI=1S/C5H5FO3S/c6-10(7,8)4-5-1-2-9-3-5/h1-3H,4H2
InChIKeyMCZURKGCDCWMNS-UHFFFAOYSA-N
XLogP1.08
TPSA47.28 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-3-yl)propane-2-sulfonamide
CID 150211021
ethane;3-ethylfuran;formaldehyde
CID 143985249
1-(furan-3-yl)-N-(furan-3-ylmethyl)methanamine
CID 115607346
2-chloro-N-(furan-3-ylmethyl)ethanesulfonamide
CID 107652513
2-[2-(furan-3-ylmethylsulfonyl)ethyl]isoindole-1,3-dione
CID 71339854
3-ethylfuran;methanol
CID 174626479
3-[chloro(dideuterio)methyl]furan
CID 169436301
N-[2-(furan-3-yl)ethyl]-1-phenylmethanesulfonamide
CID 90558389
3-amino-4-fluoro-N-(furan-3-ylmethyl)-N-methylbenzenesulfonamide
CID 61422118
N-(furan-3-ylmethyl)methanimine
CID 154530628
N-[2-(furan-3-yl)ethyl]-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 71798515
N-(furan-3-ylmethyl)-N,3,4-trimethylbenzenesulfonamide
CID 47358994

Frequently Asked Questions

What is the IUPAC name of furan-3-ylmethanesulfonyl fluoride?
The IUPAC name of furan-3-ylmethanesulfonyl fluoride (CID 165483792) is furan-3-ylmethanesulfonyl fluoride.
What is the SMILES notation for furan-3-ylmethanesulfonyl fluoride?
The canonical SMILES for furan-3-ylmethanesulfonyl fluoride is O=S(=O)(F)Cc1ccoc1.
What is the InChIKey of furan-3-ylmethanesulfonyl fluoride?
The InChIKey is MCZURKGCDCWMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FO3S/c6-10(7,8)4-5-1-2-9-3-5/h1-3H,4H2.
What are the key properties of furan-3-ylmethanesulfonyl fluoride?
furan-3-ylmethanesulfonyl fluoride has a molecular weight of 164.16 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-ylmethanesulfonyl fluoride is sourced from PubChem (CID 165483792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).