(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol

C15H13BrF2O2 — CID 115795618

IUPAC(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)c1c(F)cc(Br)cc1F
InChIInChI=1S/C15H13BrF2O2/c1-2-20-13-6-4-3-5-10(13)15(19)14-11(17)7-9(16)8-12(14)18/h3-8,15,19H,2H2,1H3
InChIKeyPGNYITJGUDJZBZ-UHFFFAOYSA-N
MW343.17 g/mol
LogP4.21
Rot. Bonds4

About (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol

(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol (PubChem CID 115795618) has the molecular formula C15H13BrF2O2 and a molecular weight of 343.17 g/mol. Its IUPAC name is (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol
PubChem CID115795618
Molecular FormulaC15H13BrF2O2
Molecular Weight343.17 g/mol
Exact Mass342.01
IUPAC Name(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)c1c(F)cc(Br)cc1F
InChIInChI=1S/C15H13BrF2O2/c1-2-20-13-6-4-3-5-10(13)15(19)14-11(17)7-9(16)8-12(14)18/h3-8,15,19H,2H2,1H3
InChIKeyPGNYITJGUDJZBZ-UHFFFAOYSA-N
XLogP4.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.17
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5-bromo-4-fluoro-2-methoxyphenyl)-(2-ethoxyphenyl)methanol
CID 103396097
(2,4-dibromophenyl)-(2-ethoxyphenyl)methanol
CID 107947466
(2-ethoxyphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63893443
(4-bromo-2,6-difluorophenyl)-(2-propoxyphenyl)methanamine
CID 105036008
(3-bromo-5-fluorophenyl)-(2-propoxyphenyl)methanol
CID 104659620
(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol
CID 107512126
(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanone
CID 114971145
2-[bromo-(2-ethoxyphenyl)methyl]-1,3-difluoro-5-methoxybenzene
CID 63434940
(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol
CID 115794091
(5-bromo-2,3-dihydro-1-benzofuran-7-yl)-(2-ethoxyphenyl)methanol
CID 104542962
(2-ethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 79721579
(3-bromo-4-fluorophenyl)-(2-propoxyphenyl)methanol
CID 104658638

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol?
The IUPAC name of (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol (CID 115795618) is (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol.
What is the SMILES notation for (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol?
The canonical SMILES for (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol is CCOc1ccccc1C(O)c1c(F)cc(Br)cc1F.
What is the InChIKey of (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol?
The InChIKey is PGNYITJGUDJZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2O2/c1-2-20-13-6-4-3-5-10(13)15(19)14-11(17)7-9(16)8-12(14)18/h3-8,15,19H,2H2,1H3.
What are the key properties of (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol?
(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol has a molecular weight of 343.17 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol is sourced from PubChem (CID 115795618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).