furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol

C12H9F3O3 — CID 62791171

IUPACfuran-2-yl-[2-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccco1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C12H9F3O3/c13-12(14,15)18-9-5-2-1-4-8(9)11(16)10-6-3-7-17-10/h1-7,11,16H
InChIKeyQVKLULZRWJGYGQ-UHFFFAOYSA-N
MW258.19 g/mol
LogP3.26
Rot. Bonds3

About furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol

furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol (PubChem CID 62791171) has the molecular formula C12H9F3O3 and a molecular weight of 258.19 g/mol. Its IUPAC name is furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Namefuran-2-yl-[2-(trifluoromethoxy)phenyl]methanol
PubChem CID62791171
Molecular FormulaC12H9F3O3
Molecular Weight258.19 g/mol
Exact Mass258.05
IUPAC Namefuran-2-yl-[2-(trifluoromethoxy)phenyl]methanol
SMILESOC(c1ccco1)c1ccccc1OC(F)(F)F
InChIInChI=1S/C12H9F3O3/c13-12(14,15)18-9-5-2-1-4-8(9)11(16)10-6-3-7-17-10/h1-7,11,16H
InChIKeyQVKLULZRWJGYGQ-UHFFFAOYSA-N
XLogP3.26
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.19
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl-[2-(trifluoromethoxy)phenyl]methanol
CID 62789776
(2-iodophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 115792609
(2-bromophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 62791669
(4-iodophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 115792623
(S)-chloro-[2-(trifluoromethoxy)phenyl]methanol
CID 130359004
1-[(R)-furan-2-yl-[2-(trifluoromethoxy)phenyl]methyl]piperazine
CID 171180697
(3,5-dibromophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 107978305
(2-methyl-4-pyridinyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 106756171
furan-2-yl-(2-phenylphenyl)methanol
CID 172878097
(3-bromo-2-chlorophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 115792552
3-(furan-2-yl)-N-methyl-1-[2-(trifluoromethoxy)phenyl]propan-1-amine
CID 105141555
(2-bromo-6-fluorophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 114885764

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol (CID 62791171) is furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol is OC(c1ccco1)c1ccccc1OC(F)(F)F.
What is the InChIKey of furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol?
The InChIKey is QVKLULZRWJGYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F3O3/c13-12(14,15)18-9-5-2-1-4-8(9)11(16)10-6-3-7-17-10/h1-7,11,16H.
What are the key properties of furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol?
furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol has a molecular weight of 258.19 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[2-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 62791171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).