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

C15H11F5O — CID 115351040

IUPAC(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(O)c2cc(F)cc(C(F)(F)F)c2)ccc1F
InChIInChI=1S/C15H11F5O/c1-8-4-9(2-3-13(8)17)14(21)10-5-11(15(18,19)20)7-12(16)6-10/h2-7,14,21H,1H3
InChIKeyLJNWOUPJUZXAJW-UHFFFAOYSA-N
MW302.24 g/mol
LogP4.37
Rot. Bonds2

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

(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol (PubChem CID 115351040) has the molecular formula C15H11F5O and a molecular weight of 302.24 g/mol. Its IUPAC name is (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
PubChem CID115351040
Molecular FormulaC15H11F5O
Molecular Weight302.24 g/mol
Exact Mass302.07
IUPAC Name(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(O)c2cc(F)cc(C(F)(F)F)c2)ccc1F
InChIInChI=1S/C15H11F5O/c1-8-4-9(2-3-13(8)17)14(21)10-5-11(15(18,19)20)7-12(16)6-10/h2-7,14,21H,1H3
InChIKeyLJNWOUPJUZXAJW-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

(3-bromo-5-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 66424633
(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751473
(3,5-dichlorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 63899311
(3,5-dibromophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 107978317
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
(4-fluoro-3-methylphenyl)-[4-(2-methylbutan-2-yl)phenyl]methanol
CID 66260153
(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 107128571
[3-fluoro-5-(trifluoromethyl)phenyl]-pyrimidin-5-ylmethanol
CID 115351139
(4-fluoro-3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanol
CID 62801811
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(1S,2R)-1-amino-1-[3-fluoro-5-(trifluoromethyl)phenyl]-3-methylbutan-2-ol;hydrochloride
CID 171268937
(1R,2S)-1-amino-1-[3-fluoro-5-(trifluoromethyl)phenyl]-3-methylbutan-2-ol;hydrochloride
CID 171263263

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol (CID 115351040) is (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol is Cc1cc(C(O)c2cc(F)cc(C(F)(F)F)c2)ccc1F.
What is the InChIKey of (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
The InChIKey is LJNWOUPJUZXAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F5O/c1-8-4-9(2-3-13(8)17)14(21)10-5-11(15(18,19)20)7-12(16)6-10/h2-7,14,21H,1H3.
What are the key properties of (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol?
(4-fluoro-3-methylphenyl)-[3-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 (4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 115351040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).