[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol

C15H13F3O3 — CID 61081110

IUPAC[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2ccccc2OC(F)F)c(F)c1
InChIInChI=1S/C15H13F3O3/c1-20-9-6-7-10(12(16)8-9)14(19)11-4-2-3-5-13(11)21-15(17)18/h2-8,14-15,19H,1H3
InChIKeyBCWWUIFBITYSNE-UHFFFAOYSA-N
MW298.26 g/mol
LogP3.52
Rot. Bonds5

About [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol

[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol (PubChem CID 61081110) has the molecular formula C15H13F3O3 and a molecular weight of 298.26 g/mol. Its IUPAC name is [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol.

Molecular Properties

Compound Name[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol
PubChem CID61081110
Molecular FormulaC15H13F3O3
Molecular Weight298.26 g/mol
Exact Mass298.08
IUPAC Name[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2ccccc2OC(F)F)c(F)c1
InChIInChI=1S/C15H13F3O3/c1-20-9-6-7-10(12(16)8-9)14(19)11-4-2-3-5-13(11)21-15(17)18/h2-8,14-15,19H,1H3
InChIKeyBCWWUIFBITYSNE-UHFFFAOYSA-N
XLogP3.52
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.26
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
[2-(difluoromethoxy)phenyl]-(2-methoxy-5-methylphenyl)methanol
CID 61081501
(2-cyclopropylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 103395056
(2,4-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61080731
(3,5-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61083265
[2-(difluoromethoxy)phenyl]-(2,3-dimethylphenyl)methanol
CID 63895942
1-[2-(difluoromethoxy)phenyl]-2-methylpropan-1-ol
CID 63894804
(5-amino-1H-pyrazol-4-yl)-(2-fluoro-4-methoxyphenyl)methanol
CID 103395395
(2,5-difluorophenyl)-(2-methoxyphenyl)methanol
CID 61100106
1-(2-fluoro-4-methoxyphenyl)propane-1,2,3-triol
CID 170817736
(2-fluoro-4-methoxyphenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 102884337
(4-chloro-2,5-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 102884370

Frequently Asked Questions

What is the IUPAC name of [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol?
The IUPAC name of [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol (CID 61081110) is [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol.
What is the SMILES notation for [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol?
The canonical SMILES for [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol is COc1ccc(C(O)c2ccccc2OC(F)F)c(F)c1.
What is the InChIKey of [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol?
The InChIKey is BCWWUIFBITYSNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O3/c1-20-9-6-7-10(12(16)8-9)14(19)11-4-2-3-5-13(11)21-15(17)18/h2-8,14-15,19H,1H3.
What are the key properties of [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol?
[2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol has a molecular weight of 298.26 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(difluoromethoxy)phenyl]-(2-fluoro-4-methoxyphenyl)methanol is sourced from PubChem (CID 61081110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).