2-fluoro-2-phenylpropan-1-ol

C9H11FO — CID 10953738

IUPAC2-fluoro-2-phenylpropan-1-ol
SMILESCC(F)(CO)c1ccccc1
InChIInChI=1S/C9H11FO/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3
InChIKeySNILNSRRYODOMT-UHFFFAOYSA-N
MW154.18 g/mol
LogP1.86
Rot. Bonds2

About 2-fluoro-2-phenylpropan-1-ol

2-fluoro-2-phenylpropan-1-ol (PubChem CID 10953738) has the molecular formula C9H11FO and a molecular weight of 154.18 g/mol. Its IUPAC name is 2-fluoro-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-fluoro-2-phenylpropan-1-ol
PubChem CID10953738
Molecular FormulaC9H11FO
Molecular Weight154.18 g/mol
Exact Mass154.08
IUPAC Name2-fluoro-2-phenylpropan-1-ol
SMILESCC(F)(CO)c1ccccc1
InChIInChI=1S/C9H11FO/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3
InChIKeySNILNSRRYODOMT-UHFFFAOYSA-N
XLogP1.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.18
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-phenylpropan-1-ol?
The IUPAC name of 2-fluoro-2-phenylpropan-1-ol (CID 10953738) is 2-fluoro-2-phenylpropan-1-ol.
What is the SMILES notation for 2-fluoro-2-phenylpropan-1-ol?
The canonical SMILES for 2-fluoro-2-phenylpropan-1-ol is CC(F)(CO)c1ccccc1.
What is the InChIKey of 2-fluoro-2-phenylpropan-1-ol?
The InChIKey is SNILNSRRYODOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO/c1-9(10,7-11)8-5-3-2-4-6-8/h2-6,11H,7H2,1H3.
What are the key properties of 2-fluoro-2-phenylpropan-1-ol?
2-fluoro-2-phenylpropan-1-ol has a molecular weight of 154.18 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-phenylpropan-1-ol is sourced from PubChem (CID 10953738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).