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

C15H11F5O — CID 107287290

IUPAC(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)c2ccc(C(F)(F)F)c(F)c2)cc1F
InChIInChI=1S/C15H11F5O/c1-8-2-3-9(6-12(8)16)14(21)10-4-5-11(13(17)7-10)15(18,19)20/h2-7,14,21H,1H3
InChIKeyJTADFKNVVQQAMD-UHFFFAOYSA-N
MW302.24 g/mol
LogP4.37
Rot. Bonds2

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

(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol (PubChem CID 107287290) has the molecular formula C15H11F5O and a molecular weight of 302.24 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
PubChem CID107287290
Molecular FormulaC15H11F5O
Molecular Weight302.24 g/mol
Exact Mass302.07
IUPAC Name(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)c2ccc(C(F)(F)F)c(F)c2)cc1F
InChIInChI=1S/C15H11F5O/c1-8-2-3-9(6-12(8)16)14(21)10-4-5-11(13(17)7-10)15(18,19)20/h2-7,14,21H,1H3
InChIKeyJTADFKNVVQQAMD-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

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Related Compounds

(2,4-dimethylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287245
(2-fluorophenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287213
(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 107128571
(4-chloro-3-methylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130625
(4-ethylsulfanylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128664
(4-bromo-5-methylthiophen-2-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287912
(3-fluoro-4-methylphenyl)-pyrimidin-5-ylmethanol
CID 62490525
(3-fluoro-4-methylphenyl)-(4-methoxyphenyl)methanol
CID 60798694
(3-fluoro-4-methylphenyl)-(3-iodophenyl)methanol
CID 107130674
(3-fluoro-4-methylphenyl)-thiophen-3-ylmethanol
CID 65099500
(3-fluoro-4-methylphenyl)-(5-fluoro-2-methylphenyl)methanol
CID 62789611
(5-ethylthiophen-2-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287311

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol (CID 107287290) is (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol is Cc1ccc(C(O)c2ccc(C(F)(F)F)c(F)c2)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol?
The InChIKey is JTADFKNVVQQAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F5O/c1-8-2-3-9(6-12(8)16)14(21)10-4-5-11(13(17)7-10)15(18,19)20/h2-7,14,21H,1H3.
What are the key properties of (3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol?
(3-fluoro-4-methylphenyl)-[3-fluoro-4-(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)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 107287290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).