1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol

C17H19FO — CID 106880244

IUPAC1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol
SMILESCc1cccc(C(C)(O)c2c(C)cc(C)cc2F)c1
InChIInChI=1S/C17H19FO/c1-11-6-5-7-14(9-11)17(4,19)16-13(3)8-12(2)10-15(16)18/h5-10,19H,1-4H3
InChIKeyMMTPAKBOLHNPJU-UHFFFAOYSA-N
MW258.34 g/mol
LogP4.01
Rot. Bonds2

About 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol

1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol (PubChem CID 106880244) has the molecular formula C17H19FO and a molecular weight of 258.34 g/mol. Its IUPAC name is 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol
PubChem CID106880244
Molecular FormulaC17H19FO
Molecular Weight258.34 g/mol
Exact Mass258.14
IUPAC Name1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol
SMILESCc1cccc(C(C)(O)c2c(C)cc(C)cc2F)c1
InChIInChI=1S/C17H19FO/c1-11-6-5-7-14(9-11)17(4,19)16-13(3)8-12(2)10-15(16)18/h5-10,19H,1-4H3
InChIKeyMMTPAKBOLHNPJU-UHFFFAOYSA-N
XLogP4.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-methoxy-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol
CID 106679488
1-(3,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62786600
1-(2,5-difluorophenyl)-1-(3-methylphenyl)ethanol
CID 62801933
1-(2-fluoro-4,6-dimethylphenyl)-1-(2-methoxyphenyl)ethanol
CID 106880255
1-cyclopropyl-1-(2-fluoro-4,6-dimethylphenyl)ethanol
CID 106880260
1-(2,3-dimethylphenyl)-1-(3-methylphenyl)ethanol
CID 62548527
ethane;1-(3-methylphenyl)-1-(3-sulfanylphenyl)ethanol
CID 144517532
1-(2,6-difluorophenyl)-2-(3-methylphenyl)propan-2-ol
CID 114930963
1-(2-fluoro-3-methoxyphenyl)-1-(3-methylphenyl)ethanol
CID 82806005
1-(4-fluoro-3-methylphenyl)-1-(3-fluorophenyl)ethanol
CID 62787951
1-(2,3-dihydrofuran-5-yl)-1-(3-methylphenyl)ethanol
CID 102650449
1-(3-chlorophenyl)-1-(2-fluoro-5-methylphenyl)ethanol
CID 62787274

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol?
The IUPAC name of 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol (CID 106880244) is 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol.
What is the SMILES notation for 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol?
The canonical SMILES for 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol is Cc1cccc(C(C)(O)c2c(C)cc(C)cc2F)c1.
What is the InChIKey of 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol?
The InChIKey is MMTPAKBOLHNPJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO/c1-11-6-5-7-14(9-11)17(4,19)16-13(3)8-12(2)10-15(16)18/h5-10,19H,1-4H3.
What are the key properties of 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol?
1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol has a molecular weight of 258.34 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4,6-dimethylphenyl)-1-(3-methylphenyl)ethanol is sourced from PubChem (CID 106880244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).