(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol

C15H13F3O — CID 822066

IUPAC(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc([C@H](O)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C15H13F3O/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h2-9,14,19H,1H3/t14-/m0/s1
InChIKeyAPVMZGGPSHYZSH-AWEZNQCLSA-N
MW266.26 g/mol
LogP4.10
Rot. Bonds2

About (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol

(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol (PubChem CID 822066) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol
PubChem CID822066
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc([C@H](O)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C15H13F3O/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h2-9,14,19H,1H3/t14-/m0/s1
InChIKeyAPVMZGGPSHYZSH-AWEZNQCLSA-N
XLogP4.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2R,3S)-2-methyl-1-(4-methylphenyl)-3-[4-(trifluoromethyl)phenyl]propane-1,3-diol
CID 102071267
(4-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 60799413
1-methyl-4-(trifluoromethyl)benzene bromide
CID 158317252
(4-bromophenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 61100365
[3,5-di(propan-2-yl)phenyl]-[4-(trifluoromethyl)phenyl]methanol
CID 123699279
[2-amino-5-(trifluoromethyl)phenyl]-(4-methylphenyl)methanol
CID 115911656
(4-methylphenyl)-[4-(4-methylphenyl)phenyl]methanol
CID 143325793
1-methyl-4-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]benzene
CID 59630308
2-(4-methylphenyl)sulfanyl-1-[4-(trifluoromethyl)phenyl]ethanol
CID 60981309
[4-[2-methyl-4-[3-methyl-4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]phenyl]-phenylmethanol
CID 123616752
(4-methylphenyl)-pyridin-4-ylmethanol
CID 3383504
(2,3-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63895822

Frequently Asked Questions

What is the IUPAC name of (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol (CID 822066) is (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol is Cc1ccc([C@H](O)c2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol?
The InChIKey is APVMZGGPSHYZSH-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H13F3O/c1-10-2-4-11(5-3-10)14(19)12-6-8-13(9-7-12)15(16,17)18/h2-9,14,19H,1H3/t14-/m0/s1.
What are the key properties of (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol?
(S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol has a molecular weight of 266.26 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 822066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).