4-fluoro-2H-furan-5-one

C4H3FO2 — CID 11094551

IUPAC4-fluoro-2H-furan-5-one
SMILESO=C1OCC=C1F
InChIInChI=1S/C4H3FO2/c5-3-1-2-7-4(3)6/h1H,2H2
InChIKeyCJNLDUJVMLMBRT-UHFFFAOYSA-N
MW102.06 g/mol
LogP0.40
Rot. Bonds

About 4-fluoro-2H-furan-5-one

4-fluoro-2H-furan-5-one (PubChem CID 11094551) has the molecular formula C4H3FO2 and a molecular weight of 102.06 g/mol. Its IUPAC name is 4-fluoro-2H-furan-5-one.

Molecular Properties

Compound Name4-fluoro-2H-furan-5-one
PubChem CID11094551
Molecular FormulaC4H3FO2
Molecular Weight102.06 g/mol
Exact Mass102.01
IUPAC Name4-fluoro-2H-furan-5-one
SMILESO=C1OCC=C1F
InChIInChI=1S/C4H3FO2/c5-3-1-2-7-4(3)6/h1H,2H2
InChIKeyCJNLDUJVMLMBRT-UHFFFAOYSA-N
XLogP0.40
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.06
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Maleic Anhydride
CID 7923
2(5H)-Furanone
CID 10341
Maleic anhydride-d2
CID 13000553
4-(Fluoromethyl)-2,5-dihydrofuran-2-one
CID 57939698
(2-~13~C)Furan-2,5-dione
CID 71308941
2,5-Furandione-2,5-13C2
CID 87229156
2,5-Furandione, 3-fluoro-
CID 12206254
Ethyl 2-fluorocrotonate
CID 15594784
3-Trifluoromethyl-2(5h)-furanone
CID 54424288
2-fluoro-2H-furan-5-one
CID 89449754
methyl (Z)-2-fluorobut-2-enoate
CID 12859989
(~13~C_4_)Furan-2,5-dione
CID 71309343

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2H-furan-5-one?
The IUPAC name of 4-fluoro-2H-furan-5-one (CID 11094551) is 4-fluoro-2H-furan-5-one.
What is the SMILES notation for 4-fluoro-2H-furan-5-one?
The canonical SMILES for 4-fluoro-2H-furan-5-one is O=C1OCC=C1F.
What is the InChIKey of 4-fluoro-2H-furan-5-one?
The InChIKey is CJNLDUJVMLMBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3FO2/c5-3-1-2-7-4(3)6/h1H,2H2.
What are the key properties of 4-fluoro-2H-furan-5-one?
4-fluoro-2H-furan-5-one has a molecular weight of 102.06 g/mol, XLogP of 0.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2H-furan-5-one is sourced from PubChem (CID 11094551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).