1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol

C16H17FO — CID 79691276

IUPAC1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(C)(O)c2cc(C)cc(F)c2)cc1
InChIInChI=1S/C16H17FO/c1-11-4-6-13(7-5-11)16(3,18)14-8-12(2)9-15(17)10-14/h4-10,18H,1-3H3
InChIKeyILBIMTFVIQMEOA-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.70
Rot. Bonds2

About 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol

1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol (PubChem CID 79691276) has the molecular formula C16H17FO and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
PubChem CID79691276
Molecular FormulaC16H17FO
Molecular Weight244.31 g/mol
Exact Mass244.13
IUPAC Name1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol
SMILESCc1ccc(C(C)(O)c2cc(C)cc(F)c2)cc1
InChIInChI=1S/C16H17FO/c1-11-4-6-13(7-5-11)16(3,18)14-8-12(2)9-15(17)10-14/h4-10,18H,1-3H3
InChIKeyILBIMTFVIQMEOA-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,4-dimethylphenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79692579
1-(3,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62786600
1-(3,4-difluorophenyl)-1-(4-methylphenyl)ethanol
CID 62801185
1-(2-bromophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 79690330
1-(3-fluoro-5-methylphenyl)-1-(2-fluorophenyl)ethanol
CID 79692201
2-(3-fluoro-5-methylphenyl)-3,3-dimethylbutan-2-ol
CID 115401195
1-[3-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylphenyl)ethanol
CID 107287051
1-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)ethanol
CID 107287052
1-(4-chlorophenyl)-1-(4-methylphenyl)ethanol
CID 60794087
1-(3,5-difluorophenyl)-2-(4-methylphenyl)propan-2-ol
CID 105402436
actinium;1-[3,5-bis(trifluoromethyl)phenyl]-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethanol
CID 22950157
1-amino-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704426

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol?
The IUPAC name of 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol (CID 79691276) is 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol?
The canonical SMILES for 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol is Cc1ccc(C(C)(O)c2cc(C)cc(F)c2)cc1.
What is the InChIKey of 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol?
The InChIKey is ILBIMTFVIQMEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO/c1-11-4-6-13(7-5-11)16(3,18)14-8-12(2)9-15(17)10-14/h4-10,18H,1-3H3.
What are the key properties of 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol?
1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol has a molecular weight of 244.31 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-methylphenyl)-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 79691276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).