1-(2-fluoro-3,5-dimethoxyphenyl)ethanol

C10H13FO3 — CID 117289259

IUPAC1-(2-fluoro-3,5-dimethoxyphenyl)ethanol
SMILESCOc1cc(OC)c(F)c(C(C)O)c1
InChIInChI=1S/C10H13FO3/c1-6(12)8-4-7(13-2)5-9(14-3)10(8)11/h4-6,12H,1-3H3
InChIKeyOVPFFCRUQGQDGW-UHFFFAOYSA-N
MW200.21 g/mol
LogP1.90
Rot. Bonds3

About 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol

1-(2-fluoro-3,5-dimethoxyphenyl)ethanol (PubChem CID 117289259) has the molecular formula C10H13FO3 and a molecular weight of 200.21 g/mol. Its IUPAC name is 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2-fluoro-3,5-dimethoxyphenyl)ethanol
PubChem CID117289259
Molecular FormulaC10H13FO3
Molecular Weight200.21 g/mol
Exact Mass200.08
IUPAC Name1-(2-fluoro-3,5-dimethoxyphenyl)ethanol
SMILESCOc1cc(OC)c(F)c(C(C)O)c1
InChIInChI=1S/C10H13FO3/c1-6(12)8-4-7(13-2)5-9(14-3)10(8)11/h4-6,12H,1-3H3
InChIKeyOVPFFCRUQGQDGW-UHFFFAOYSA-N
XLogP1.90
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.21
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(2,4-dimethoxyphenyl)ethanol
CID 25324308
(3,5-dimethoxy-2-methylphenyl)methanediol
CID 123413723
1-(difluoromethyl)-2-iodo-3,5-dimethoxybenzene
CID 130926019
(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
CID 26597266
1-(3-bromo-5-methoxy-2-methylphenyl)ethanol
CID 84704874
1-(2-bromo-4,6-dimethoxyphenyl)ethanol
CID 84710416
(1S)-1-(3,4-difluoro-5-methoxyphenyl)ethanol
CID 97293354
(1R)-1-(2,4,5-trimethoxyphenyl)ethanol
CID 163198569
1-(2-fluoro-4-methoxy-5-methylphenyl)ethanol
CID 84659572
2-chloro-5-[fluoro-(2-fluoro-3,5-dimethoxyphenyl)methoxy]pyrimidine
CID 122604537
1,2,3,4,5-pentafluoro-6-(2,4,6-trimethoxyphenyl)benzene
CID 102431568
1-(4,5-dimethoxy-2-propan-2-ylphenyl)ethanol
CID 117322382

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol?
The IUPAC name of 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol (CID 117289259) is 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol.
What is the SMILES notation for 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol?
The canonical SMILES for 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol is COc1cc(OC)c(F)c(C(C)O)c1.
What is the InChIKey of 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol?
The InChIKey is OVPFFCRUQGQDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO3/c1-6(12)8-4-7(13-2)5-9(14-3)10(8)11/h4-6,12H,1-3H3.
What are the key properties of 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol?
1-(2-fluoro-3,5-dimethoxyphenyl)ethanol has a molecular weight of 200.21 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-3,5-dimethoxyphenyl)ethanol is sourced from PubChem (CID 117289259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).