1-(2,3-difluoro-6-methoxyphenyl)ethanol

C9H10F2O2 — CID 58022414

IUPAC1-(2,3-difluoro-6-methoxyphenyl)ethanol
SMILESCOc1ccc(F)c(F)c1C(C)O
InChIInChI=1S/C9H10F2O2/c1-5(12)8-7(13-2)4-3-6(10)9(8)11/h3-5,12H,1-2H3
InChIKeyNWISWZBYXJKMEA-UHFFFAOYSA-N
MW188.17 g/mol
LogP2.03
Rot. Bonds2

About 1-(2,3-difluoro-6-methoxyphenyl)ethanol

1-(2,3-difluoro-6-methoxyphenyl)ethanol (PubChem CID 58022414) has the molecular formula C9H10F2O2 and a molecular weight of 188.17 g/mol. Its IUPAC name is 1-(2,3-difluoro-6-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2,3-difluoro-6-methoxyphenyl)ethanol
PubChem CID58022414
Molecular FormulaC9H10F2O2
Molecular Weight188.17 g/mol
Exact Mass188.06
IUPAC Name1-(2,3-difluoro-6-methoxyphenyl)ethanol
SMILESCOc1ccc(F)c(F)c1C(C)O
InChIInChI=1S/C9H10F2O2/c1-5(12)8-7(13-2)4-3-6(10)9(8)11/h3-5,12H,1-2H3
InChIKeyNWISWZBYXJKMEA-UHFFFAOYSA-N
XLogP2.03
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.17
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-fluoro-6-methoxy-3-(methoxymethyl)phenyl]ethanol
CID 117305499
1-(2-bromo-3,6-dimethoxyphenyl)ethanol
CID 117406483
1-(3,6-difluoro-2-methoxyphenyl)ethanol
CID 84661307
1-[2-(2-fluoro-3-methylphenoxy)-6-methoxyphenyl]ethanol
CID 107659175
1-(2,6-difluoro-3-methoxyphenyl)ethanamine
CID 55272050
1-[3,6-dimethoxy-2-(methoxymethyl)phenyl]ethanol
CID 117325541
1,2-difluoro-3,4-dimethoxybenzene
CID 67100030
2-(2-fluoro-3,6-dimethoxyphenyl)propan-1-ol
CID 117305436
2-(3-fluoro-2,6-dimethoxyphenyl)propanoic acid
CID 117328468
1-(6-bromo-3-fluoro-2-methoxyphenyl)ethanol
CID 84706864
1-(2-fluoro-4-methoxy-3-methylsulfonylphenyl)ethanol
CID 117373186
2,2-dichloro-1-(2-fluoro-6-methoxy-3-methylphenyl)ethanol
CID 171367447

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-difluoro-6-methoxyphenyl)ethanol?
The IUPAC name of 1-(2,3-difluoro-6-methoxyphenyl)ethanol (CID 58022414) is 1-(2,3-difluoro-6-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2,3-difluoro-6-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2,3-difluoro-6-methoxyphenyl)ethanol is COc1ccc(F)c(F)c1C(C)O.
What is the InChIKey of 1-(2,3-difluoro-6-methoxyphenyl)ethanol?
The InChIKey is NWISWZBYXJKMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2O2/c1-5(12)8-7(13-2)4-3-6(10)9(8)11/h3-5,12H,1-2H3.
What are the key properties of 1-(2,3-difluoro-6-methoxyphenyl)ethanol?
1-(2,3-difluoro-6-methoxyphenyl)ethanol has a molecular weight of 188.17 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-difluoro-6-methoxyphenyl)ethanol is sourced from PubChem (CID 58022414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).