2-fluoro-2-methylpropan-1-ol

C4H9FO — CID 11126179

IUPAC2-fluoro-2-methylpropan-1-ol
SMILESCC(C)(F)CO
InChIInChI=1S/C4H9FO/c1-4(2,5)3-6/h6H,3H2,1-2H3
InChIKeyVQDNMKWCOYVVJH-UHFFFAOYSA-N
MW92.11 g/mol
LogP0.73
Rot. Bonds1

About 2-fluoro-2-methylpropan-1-ol

2-fluoro-2-methylpropan-1-ol (PubChem CID 11126179) has the molecular formula C4H9FO and a molecular weight of 92.11 g/mol. Its IUPAC name is 2-fluoro-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-fluoro-2-methylpropan-1-ol
PubChem CID11126179
Molecular FormulaC4H9FO
Molecular Weight92.11 g/mol
Exact Mass92.06
IUPAC Name2-fluoro-2-methylpropan-1-ol
SMILESCC(C)(F)CO
InChIInChI=1S/C4H9FO/c1-4(2,5)3-6/h6H,3H2,1-2H3
InChIKeyVQDNMKWCOYVVJH-UHFFFAOYSA-N
XLogP0.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.11
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Isobutanol
CID 6560
Neopentyl alcohol
CID 6404
4-Fluorobutan-1-ol
CID 9755
3-Fluorobutan-1-ol
CID 14117409
2-Fluoropropan-1-ol
CID 13278457
2-Fluoro-1-butanol
CID 13278455
3-Fluoro-2-methylpropan-1-ol
CID 54169163
3,3,3-Trifluoro-2,2-dimethylpropan-1-ol
CID 59951355
3,3-Difluoro-2-methylpropan-1-ol
CID 78061721
(2S)-2-fluoropropan-1-ol
CID 11528331
(2S)-2-fluoro-3-methylbutan-1-ol
CID 10582748
1-Fluorobutan-2-ol
CID 13278453

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methylpropan-1-ol?
The IUPAC name of 2-fluoro-2-methylpropan-1-ol (CID 11126179) is 2-fluoro-2-methylpropan-1-ol.
What is the SMILES notation for 2-fluoro-2-methylpropan-1-ol?
The canonical SMILES for 2-fluoro-2-methylpropan-1-ol is CC(C)(F)CO.
What is the InChIKey of 2-fluoro-2-methylpropan-1-ol?
The InChIKey is VQDNMKWCOYVVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FO/c1-4(2,5)3-6/h6H,3H2,1-2H3.
What are the key properties of 2-fluoro-2-methylpropan-1-ol?
2-fluoro-2-methylpropan-1-ol has a molecular weight of 92.11 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methylpropan-1-ol is sourced from PubChem (CID 11126179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).