(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol

C17H17F3O — CID 102751424

IUPAC(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(F)(F)F)ccc1C(O)c1cccc(C)c1C
InChIInChI=1S/C17H17F3O/c1-10-5-4-6-15(12(10)3)16(21)14-8-7-13(9-11(14)2)17(18,19)20/h4-9,16,21H,1-3H3
InChIKeyVQBLAJIAUDZZLY-UHFFFAOYSA-N
MW294.32 g/mol
LogP4.71
Rot. Bonds2

About (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol

(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol (PubChem CID 102751424) has the molecular formula C17H17F3O and a molecular weight of 294.32 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
PubChem CID102751424
Molecular FormulaC17H17F3O
Molecular Weight294.32 g/mol
Exact Mass294.12
IUPAC Name(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(F)(F)F)ccc1C(O)c1cccc(C)c1C
InChIInChI=1S/C17H17F3O/c1-10-5-4-6-15(12(10)3)16(21)14-8-7-13(9-11(14)2)17(18,19)20/h4-9,16,21H,1-3H3
InChIKeyVQBLAJIAUDZZLY-UHFFFAOYSA-N
XLogP4.71
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.32
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-chloro-2-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 107103538
(2,3-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63895822
[2-methyl-4-(trifluoromethyl)phenyl]-phenylmethanol
CID 102751287
[2-bromo-5-(trifluoromethyl)phenyl]-(2-methylphenyl)methanol
CID 114979165
(2,5-dibromophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102759051
1,2-dimethyl-3-[1-[4-(trifluoromethyl)phenyl]ethyl]benzene
CID 134982830
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751473
(2,4-dimethylphenyl)-[2-(trifluoromethyl)phenyl]methanol
CID 61101273
(3-bromofuran-2-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 106886320
(3-bromo-4-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751415
1-[2-methyl-4-(trifluoromethyl)phenyl]-4-sulfanylbutane-1,2-diol
CID 171874604

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol (CID 102751424) is (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol is Cc1cc(C(F)(F)F)ccc1C(O)c1cccc(C)c1C.
What is the InChIKey of (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The InChIKey is VQBLAJIAUDZZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3O/c1-10-5-4-6-15(12(10)3)16(21)14-8-7-13(9-11(14)2)17(18,19)20/h4-9,16,21H,1-3H3.
What are the key properties of (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
(2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol has a molecular weight of 294.32 g/mol, XLogP of 4.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 102751424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).