(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol

C17H15F3O — CID 79970705

IUPAC(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cccc(C(F)(F)F)c1)c1ccccc1C1CC1
InChIInChI=1S/C17H15F3O/c18-17(19,20)13-5-3-4-12(10-13)16(21)15-7-2-1-6-14(15)11-8-9-11/h1-7,10-11,16,21H,8-9H2
InChIKeyAQLRFUSVRBZJGG-UHFFFAOYSA-N
MW292.30 g/mol
LogP4.66
Rot. Bonds3

About (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol

(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol (PubChem CID 79970705) has the molecular formula C17H15F3O and a molecular weight of 292.30 g/mol. Its IUPAC name is (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol
PubChem CID79970705
Molecular FormulaC17H15F3O
Molecular Weight292.30 g/mol
Exact Mass292.11
IUPAC Name(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol
SMILESOC(c1cccc(C(F)(F)F)c1)c1ccccc1C1CC1
InChIInChI=1S/C17H15F3O/c18-17(19,20)13-5-3-4-12(10-13)16(21)15-7-2-1-6-14(15)11-8-9-11/h1-7,10-11,16,21H,8-9H2
InChIKeyAQLRFUSVRBZJGG-UHFFFAOYSA-N
XLogP4.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.30
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-cyclopropylphenyl)-(4-propan-2-ylphenyl)methanol
CID 79983378
(2-cyclopropylphenyl)-pyridin-3-ylmethanol
CID 79982582
cyclobutyl-[3-(trifluoromethyl)phenyl]methanol
CID 64986539
(2-fluoro-5-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 62791138
(2-cyclobutylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 114601272
(4-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 60799413
(3,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 107978303
pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11425288
pyrimidin-5-yl-[3-(trifluoromethyl)phenyl]methanol
CID 62491180
piperidin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11392289
thiophen-3-yl-[3-(trifluoromethyl)phenyl]methanol
CID 62789605
(2-cyclopropylphenyl)-(4-propylphenyl)methanol
CID 79982407

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol (CID 79970705) is (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol is OC(c1cccc(C(F)(F)F)c1)c1ccccc1C1CC1.
What is the InChIKey of (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol?
The InChIKey is AQLRFUSVRBZJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3O/c18-17(19,20)13-5-3-4-12(10-13)16(21)15-7-2-1-6-14(15)11-8-9-11/h1-7,10-11,16,21H,8-9H2.
What are the key properties of (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol?
(2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol has a molecular weight of 292.30 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylphenyl)-[3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 79970705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).