1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol

C15H14ClFO3 — CID 109416021

IUPAC1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol
SMILESCOc1cccc(F)c1OCC(O)c1ccccc1Cl
InChIInChI=1S/C15H14ClFO3/c1-19-14-8-4-7-12(17)15(14)20-9-13(18)10-5-2-3-6-11(10)16/h2-8,13,18H,9H2,1H3
InChIKeyJRLZUWUJWRVMCY-UHFFFAOYSA-N
MW296.73 g/mol
LogP3.60
Rot. Bonds5

About 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol

1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol (PubChem CID 109416021) has the molecular formula C15H14ClFO3 and a molecular weight of 296.73 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol
PubChem CID109416021
Molecular FormulaC15H14ClFO3
Molecular Weight296.73 g/mol
Exact Mass296.06
IUPAC Name1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol
SMILESCOc1cccc(F)c1OCC(O)c1ccccc1Cl
InChIInChI=1S/C15H14ClFO3/c1-19-14-8-4-7-12(17)15(14)20-9-13(18)10-5-2-3-6-11(10)16/h2-8,13,18H,9H2,1H3
InChIKeyJRLZUWUJWRVMCY-UHFFFAOYSA-N
XLogP3.60
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.73
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-bromophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol
CID 109416024
2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanol
CID 63038192
1-[(2-chlorophenyl)methoxy]-3-(2-fluoro-6-methoxyphenoxy)propan-2-ol
CID 109416037
2-(2-fluoro-6-methoxyphenoxy)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 109416014
1-(2-fluoro-6-methoxyphenoxy)-3-[(2-fluorophenyl)methoxy]propan-2-ol
CID 109416030
(2R)-3-(2-chloro-6-methoxyphenoxy)propane-1,2-diol
CID 141307295
1-(5-chloro-2-methoxyphenyl)-2-phenoxyethanol
CID 62790142
2-[2-(2-chlorophenyl)-2-hydroxyethoxy]benzonitrile
CID 109413414
2-(4-chlorophenyl)-1-(2-fluoro-3-methoxyphenyl)ethanol
CID 82807893
2-(3-chloro-2-fluorophenyl)-1-(2,3-dimethoxyphenyl)ethanamine
CID 102867085
2-(3-fluorophenoxy)-1-(2-fluorophenyl)ethanol
CID 110885745
1-fluoro-2-methoxy-3-propan-2-ylbenzene;4-fluoro-1-methoxy-2-propan-2-ylbenzene
CID 177172407

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol?
The IUPAC name of 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol (CID 109416021) is 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol.
What is the SMILES notation for 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol?
The canonical SMILES for 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol is COc1cccc(F)c1OCC(O)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol?
The InChIKey is JRLZUWUJWRVMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO3/c1-19-14-8-4-7-12(17)15(14)20-9-13(18)10-5-2-3-6-11(10)16/h2-8,13,18H,9H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol?
1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol has a molecular weight of 296.73 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-(2-fluoro-6-methoxyphenoxy)ethanol is sourced from PubChem (CID 109416021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).