2-(3-fluorophenyl)-2-methoxypropan-1-ol

C10H13FO2 — CID 105441079

IUPAC2-(3-fluorophenyl)-2-methoxypropan-1-ol
SMILESCOC(C)(CO)c1cccc(F)c1
InChIInChI=1S/C10H13FO2/c1-10(7-12,13-2)8-4-3-5-9(11)6-8/h3-6,12H,7H2,1-2H3
InChIKeyJLXPXXIJBAIFBZ-UHFFFAOYSA-N
MW184.21 g/mol
LogP1.68
Rot. Bonds3

About 2-(3-fluorophenyl)-2-methoxypropan-1-ol

2-(3-fluorophenyl)-2-methoxypropan-1-ol (PubChem CID 105441079) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-2-methoxypropan-1-ol.

Molecular Properties

Compound Name2-(3-fluorophenyl)-2-methoxypropan-1-ol
PubChem CID105441079
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name2-(3-fluorophenyl)-2-methoxypropan-1-ol
SMILESCOC(C)(CO)c1cccc(F)c1
InChIInChI=1S/C10H13FO2/c1-10(7-12,13-2)8-4-3-5-9(11)6-8/h3-6,12H,7H2,1-2H3
InChIKeyJLXPXXIJBAIFBZ-UHFFFAOYSA-N
XLogP1.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluorophenyl)-2-methylpropane-1,3-diol
CID 79450508
methyl 3-(3-fluorophenyl)-4-hydroxy-3-methylbutanoate
CID 105483806
2-(3-fluorophenyl)-2-[(3-methoxyphenyl)methyl]propane-1,3-diol
CID 79445073
2-(3-fluorophenyl)-2-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diol
CID 112592515
1-bromo-1-(3-fluorophenyl)ethanol
CID 143635660
1-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)ethanol
CID 62787268
3-(3-fluorophenyl)-4-hydroxy-3-methylbutanoic acid
CID 105465813
(2S)-2-(3-fluorophenyl)pentan-2-ol
CID 93299056
2-(3-fluorophenoxy)-2-methylpropan-1-ol
CID 82075160
1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
CID 105402440
2-(3-bromoanilino)-2-(3-fluorophenyl)propan-1-ol
CID 61048867
2-(3-fluorophenyl)-2-pentylpropane-1,3-diol
CID 79449979

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-2-methoxypropan-1-ol?
The IUPAC name of 2-(3-fluorophenyl)-2-methoxypropan-1-ol (CID 105441079) is 2-(3-fluorophenyl)-2-methoxypropan-1-ol.
What is the SMILES notation for 2-(3-fluorophenyl)-2-methoxypropan-1-ol?
The canonical SMILES for 2-(3-fluorophenyl)-2-methoxypropan-1-ol is COC(C)(CO)c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-2-methoxypropan-1-ol?
The InChIKey is JLXPXXIJBAIFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-10(7-12,13-2)8-4-3-5-9(11)6-8/h3-6,12H,7H2,1-2H3.
What are the key properties of 2-(3-fluorophenyl)-2-methoxypropan-1-ol?
2-(3-fluorophenyl)-2-methoxypropan-1-ol has a molecular weight of 184.21 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-2-methoxypropan-1-ol is sourced from PubChem (CID 105441079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).