[2-methoxy-6-(trifluoromethoxy)phenyl]methanol

C9H9F3O3 — CID 134638773

IUPAC[2-methoxy-6-(trifluoromethoxy)phenyl]methanol
SMILESCOc1cccc(OC(F)(F)F)c1CO
InChIInChI=1S/C9H9F3O3/c1-14-7-3-2-4-8(6(7)5-13)15-9(10,11)12/h2-4,13H,5H2,1H3
InChIKeyHLTQDLGJAAYMSW-UHFFFAOYSA-N
MW222.16 g/mol
LogP2.09
Rot. Bonds3

About [2-methoxy-6-(trifluoromethoxy)phenyl]methanol

[2-methoxy-6-(trifluoromethoxy)phenyl]methanol (PubChem CID 134638773) has the molecular formula C9H9F3O3 and a molecular weight of 222.16 g/mol. Its IUPAC name is [2-methoxy-6-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Name[2-methoxy-6-(trifluoromethoxy)phenyl]methanol
PubChem CID134638773
Molecular FormulaC9H9F3O3
Molecular Weight222.16 g/mol
Exact Mass222.05
IUPAC Name[2-methoxy-6-(trifluoromethoxy)phenyl]methanol
SMILESCOc1cccc(OC(F)(F)F)c1CO
InChIInChI=1S/C9H9F3O3/c1-14-7-3-2-4-8(6(7)5-13)15-9(10,11)12/h2-4,13H,5H2,1H3
InChIKeyHLTQDLGJAAYMSW-UHFFFAOYSA-N
XLogP2.09
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.16
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-bromo-6-(trifluoromethoxy)phenyl]methanol
CID 66770602
(2-methoxy-6-sulfanylphenyl)methanol
CID 130129836
2-ethyl-1-fluoro-3-(trifluoromethoxy)benzene
CID 131169258
ethyl 2-methoxy-6-(trifluoromethoxy)benzoate
CID 170997101
2-ethyl-3-(trifluoromethoxy)benzenethiol
CID 170999052
1-methoxy-2-phenyl-3-(trifluoromethoxy)benzene
CID 18770174
2-[3-methoxy-2-(trifluoromethoxy)phenyl]acetic acid
CID 170997113
3-(hydroxymethyl)-5-methoxy-2-(trifluoromethoxy)-1H-pyridin-4-one
CID 118816283
(2,3-dibromo-6-methoxyphenyl)methanol
CID 171002454
2-methoxy-6-(trifluoromethoxy)benzenesulfonamide
CID 125434816
1-[2-(chloromethyl)-6-(trifluoromethoxy)phenyl]propan-2-one
CID 166640657
N-[[2-methoxy-6-(trifluoromethoxy)phenyl]methyl]-1,4,5,6-tetrahydropyrimidin-2-amine;hydroiodide
CID 120967403

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-6-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of [2-methoxy-6-(trifluoromethoxy)phenyl]methanol (CID 134638773) is [2-methoxy-6-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for [2-methoxy-6-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for [2-methoxy-6-(trifluoromethoxy)phenyl]methanol is COc1cccc(OC(F)(F)F)c1CO.
What is the InChIKey of [2-methoxy-6-(trifluoromethoxy)phenyl]methanol?
The InChIKey is HLTQDLGJAAYMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3O3/c1-14-7-3-2-4-8(6(7)5-13)15-9(10,11)12/h2-4,13H,5H2,1H3.
What are the key properties of [2-methoxy-6-(trifluoromethoxy)phenyl]methanol?
[2-methoxy-6-(trifluoromethoxy)phenyl]methanol has a molecular weight of 222.16 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-6-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 134638773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).