1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol

C16H17FO2 — CID 62790475

IUPAC1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1ccc(F)cc1C
InChIInChI=1S/C16H17FO2/c1-11-9-13(17)7-8-14(11)15(18)10-12-5-3-4-6-16(12)19-2/h3-9,15,18H,10H2,1-2H3
InChIKeyVJMPOWGJHZVOPT-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.42
Rot. Bonds4

About 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol

1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol (PubChem CID 62790475) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol
PubChem CID62790475
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1ccc(F)cc1C
InChIInChI=1S/C16H17FO2/c1-11-9-13(17)7-8-14(11)15(18)10-12-5-3-4-6-16(12)19-2/h3-9,15,18H,10H2,1-2H3
InChIKeyVJMPOWGJHZVOPT-UHFFFAOYSA-N
XLogP3.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol (CID 62790475) is 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol is COc1ccccc1CC(O)c1ccc(F)cc1C.
What is the InChIKey of 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol?
The InChIKey is VJMPOWGJHZVOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-11-9-13(17)7-8-14(11)15(18)10-12-5-3-4-6-16(12)19-2/h3-9,15,18H,10H2,1-2H3.
What are the key properties of 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol?
1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 62790475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).