5-fluoro-5-methyl-1,3-dioxolan-4-ol

C4H7FO3 — CID 175877515

IUPAC5-fluoro-5-methyl-1,3-dioxolan-4-ol
SMILESCC1(F)OCOC1O
InChIInChI=1S/C4H7FO3/c1-4(5)3(6)7-2-8-4/h3,6H,2H2,1H3
InChIKeyPOQLQDOUZHCRPJ-UHFFFAOYSA-N
MW122.09 g/mol
LogP-0.01
Rot. Bonds

About 5-fluoro-5-methyl-1,3-dioxolan-4-ol

5-fluoro-5-methyl-1,3-dioxolan-4-ol (PubChem CID 175877515) has the molecular formula C4H7FO3 and a molecular weight of 122.09 g/mol. Its IUPAC name is 5-fluoro-5-methyl-1,3-dioxolan-4-ol.

Molecular Properties

Compound Name5-fluoro-5-methyl-1,3-dioxolan-4-ol
PubChem CID175877515
Molecular FormulaC4H7FO3
Molecular Weight122.09 g/mol
Exact Mass122.04
IUPAC Name5-fluoro-5-methyl-1,3-dioxolan-4-ol
SMILESCC1(F)OCOC1O
InChIInChI=1S/C4H7FO3/c1-4(5)3(6)7-2-8-4/h3,6H,2H2,1H3
InChIKeyPOQLQDOUZHCRPJ-UHFFFAOYSA-N
XLogP-0.01
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.09
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-5-methyl-1,3-dioxolan-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1-fluoro-1,2-dimethylcyclopropane
CID 147738297
(3S)-2-methyloxolane-2,3-diol
CID 134855830
(3S,3aR,6R,6aS)-3,6-dimethyl-2,3a,5,6a-tetrahydrofuro[3,2-b]furan-3,6-diol
CID 68824826
2-but-2-en-2-yl-1,3-dioxetane
CID 123232646
(2R,4R,5R)-3,3-difluorooxane-2,4,5-triol
CID 10855910
(1R)-1-fluoro-2-iodo-1-methylcyclopropane
CID 131968252
(3R)-2,2-dimethyloxolan-3-ol
CID 13327311
(3S,4S,5R)-2-methyloxane-2,3,4,5-tetrol
CID 102453556
(1'S,2'R,4'R)-1',7',7'-trimethylspiro[1,3-dioxolane-2,3'-bicyclo[2.2.1]heptane]-2'-ol
CID 22216407
2,2-difluorooxetane;fluoromethane;molecular fluorine
CID 157131150
(3R,4R)-6,6-difluoro-3,4-dimethyloxan-3-ol
CID 171582112
ethane;2-methyl-2-(trifluoromethyl)oxetane
CID 177148126

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-5-methyl-1,3-dioxolan-4-ol?
The IUPAC name of 5-fluoro-5-methyl-1,3-dioxolan-4-ol (CID 175877515) is 5-fluoro-5-methyl-1,3-dioxolan-4-ol.
What is the SMILES notation for 5-fluoro-5-methyl-1,3-dioxolan-4-ol?
The canonical SMILES for 5-fluoro-5-methyl-1,3-dioxolan-4-ol is CC1(F)OCOC1O.
What is the InChIKey of 5-fluoro-5-methyl-1,3-dioxolan-4-ol?
The InChIKey is POQLQDOUZHCRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7FO3/c1-4(5)3(6)7-2-8-4/h3,6H,2H2,1H3.
What are the key properties of 5-fluoro-5-methyl-1,3-dioxolan-4-ol?
5-fluoro-5-methyl-1,3-dioxolan-4-ol has a molecular weight of 122.09 g/mol, XLogP of -0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-5-methyl-1,3-dioxolan-4-ol is sourced from PubChem (CID 175877515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).