(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol

C15H11F5O — CID 107128571

IUPAC(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)c2cc(C(F)(F)F)ccc2F)cc1F
InChIInChI=1S/C15H11F5O/c1-8-2-3-9(6-13(8)17)14(21)11-7-10(15(18,19)20)4-5-12(11)16/h2-7,14,21H,1H3
InChIKeyCYNSKFUSBPDGNE-UHFFFAOYSA-N
MW302.24 g/mol
LogP4.37
Rot. Bonds2

About (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol

(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol (PubChem CID 107128571) has the molecular formula C15H11F5O and a molecular weight of 302.24 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
PubChem CID107128571
Molecular FormulaC15H11F5O
Molecular Weight302.24 g/mol
Exact Mass302.07
IUPAC Name(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)c2cc(C(F)(F)F)ccc2F)cc1F
InChIInChI=1S/C15H11F5O/c1-8-2-3-9(6-13(8)17)14(21)11-7-10(15(18,19)20)4-5-12(11)16/h2-7,14,21H,1H3
InChIKeyCYNSKFUSBPDGNE-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.24
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (3-fluoro-4-methylphenyl)-[2-fluoro-5-(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-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 107560100
(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751473
(3-bromo-4-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751415
(2-fluoro-5-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 62791138
(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287290
(3,5-dimethylthiophen-2-yl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 81157519
(3-fluoro-4-methylphenyl)-(5-fluoro-2-methylphenyl)methanol
CID 62789611
[2-fluoro-5-(trifluoromethyl)phenyl]-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanol
CID 140866705
(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 115351040
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
1-chloro-1-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-ol
CID 69345196

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol (CID 107128571) is (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol is Cc1ccc(C(O)c2cc(C(F)(F)F)ccc2F)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol?
The InChIKey is CYNSKFUSBPDGNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F5O/c1-8-2-3-9(6-13(8)17)14(21)11-7-10(15(18,19)20)4-5-12(11)16/h2-7,14,21H,1H3.
What are the key properties of (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol?
(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol has a molecular weight of 302.24 g/mol, XLogP of 4.37, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 107128571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).