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

C16H14F4O — CID 102751473

IUPAC(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(O)c2ccc(C(F)(F)F)cc2C)ccc1F
InChIInChI=1S/C16H14F4O/c1-9-8-12(16(18,19)20)4-5-13(9)15(21)11-3-6-14(17)10(2)7-11/h3-8,15,21H,1-2H3
InChIKeyBSUVPDXOUDXQDX-UHFFFAOYSA-N
MW298.28 g/mol
LogP4.54
Rot. Bonds2

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

(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol (PubChem CID 102751473) has the molecular formula C16H14F4O and a molecular weight of 298.28 g/mol. Its IUPAC name is (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
PubChem CID102751473
Molecular FormulaC16H14F4O
Molecular Weight298.28 g/mol
Exact Mass298.10
IUPAC Name(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
SMILESCc1cc(C(O)c2ccc(C(F)(F)F)cc2C)ccc1F
InChIInChI=1S/C16H14F4O/c1-9-8-12(16(18,19)20)4-5-13(9)15(21)11-3-6-14(17)10(2)7-11/h3-8,15,21H,1-2H3
InChIKeyBSUVPDXOUDXQDX-UHFFFAOYSA-N
XLogP4.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.28
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-bromo-4-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751415
(3-fluoro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 107128571
[2-methyl-4-(trifluoromethyl)phenyl]-phenylmethanol
CID 102751287
(4-fluoro-3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanol
CID 62801811
(4-fluoro-3-methylphenyl)-[3-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 115351040
(3-chloro-4-methylphenyl)-[2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 107560100
[2-methyl-4-(trifluoromethyl)phenyl]-pyridin-4-ylmethanol
CID 102751290
2-chloro-1-propan-2-yl-4-(trifluoromethyl)benzene;1-fluoro-2-methyl-4-propan-2-ylbenzene
CID 144880341
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
(2,4-dimethylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287245
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol (CID 102751473) is (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol is Cc1cc(C(O)c2ccc(C(F)(F)F)cc2C)ccc1F.
What is the InChIKey of (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
The InChIKey is BSUVPDXOUDXQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F4O/c1-9-8-12(16(18,19)20)4-5-13(9)15(21)11-3-6-14(17)10(2)7-11/h3-8,15,21H,1-2H3.
What are the key properties of (4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol?
(4-fluoro-3-methylphenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol has a molecular weight of 298.28 g/mol, XLogP of 4.54, 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)-[2-methyl-4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 102751473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).