2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol

C11H15FO3 — CID 117305436

IUPAC2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol
SMILESCOc1ccc(OC)c(C(C)CO)c1F
InChIInChI=1S/C11H15FO3/c1-7(6-13)10-8(14-2)4-5-9(15-3)11(10)12/h4-5,7,13H,6H2,1-3H3
InChIKeyIDTPQOSYMGEOLS-UHFFFAOYSA-N
MW214.24 g/mol
LogP1.94
Rot. Bonds4

About 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol

2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol (PubChem CID 117305436) has the molecular formula C11H15FO3 and a molecular weight of 214.24 g/mol. Its IUPAC name is 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol
PubChem CID117305436
Molecular FormulaC11H15FO3
Molecular Weight214.24 g/mol
Exact Mass214.10
IUPAC Name2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol
SMILESCOc1ccc(OC)c(C(C)CO)c1F
InChIInChI=1S/C11H15FO3/c1-7(6-13)10-8(14-2)4-5-9(15-3)11(10)12/h4-5,7,13H,6H2,1-3H3
InChIKeyIDTPQOSYMGEOLS-UHFFFAOYSA-N
XLogP1.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromo-2-fluoro-4-methoxyphenyl)propan-1-ol
CID 117411724
2-(3,6-dimethoxy-2-methylphenyl)propan-1-ol
CID 117300482
2-(1-hydroxypropan-2-yl)-3-methoxy-6-methylphenol
CID 117286277
2-(3-bromo-2,6-difluoro-4-methoxyphenyl)propan-1-ol
CID 117451005
2-(2-methoxy-6-methylsulfanylphenyl)propan-1-ol
CID 117303266
2-[2-(fluoromethyl)-6-methoxyphenyl]propan-1-ol
CID 117287951
2-(1-amino-2-hydroxyethyl)-3-fluoro-4-methoxyphenol
CID 84776111
2-(3-chloro-2,6-difluoro-4-methoxyphenyl)propan-1-ol
CID 117345751
2-(2,3-dimethoxy-6-propan-2-ylphenyl)propan-1-ol
CID 117349610
2-(5-methoxy-1,3-benzodioxol-4-yl)propan-1-ol
CID 117300233
3-amino-3-(6-bromo-2-fluoro-3-methoxyphenyl)propan-1-ol
CID 84714745
2-(6-bromo-2-ethoxy-3-methoxyphenyl)propan-1-ol
CID 117467060

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol?
The IUPAC name of 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol (CID 117305436) is 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol.
What is the SMILES notation for 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol?
The canonical SMILES for 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol is COc1ccc(OC)c(C(C)CO)c1F.
What is the InChIKey of 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol?
The InChIKey is IDTPQOSYMGEOLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FO3/c1-7(6-13)10-8(14-2)4-5-9(15-3)11(10)12/h4-5,7,13H,6H2,1-3H3.
What are the key properties of 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol?
2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol has a molecular weight of 214.24 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol is sourced from PubChem (CID 117305436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).