[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol

C14H11BrClFO2 — CID 28825760

IUPAC[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cc(Br)ccc1OCc1ccc(F)cc1Cl
InChIInChI=1S/C14H11BrClFO2/c15-11-2-4-14(10(5-11)7-18)19-8-9-1-3-12(17)6-13(9)16/h1-6,18H,7-8H2
InChIKeyINBGLQWJJZATNV-UHFFFAOYSA-N
MW345.60 g/mol
LogP4.31
Rot. Bonds4

About [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol

[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol (PubChem CID 28825760) has the molecular formula C14H11BrClFO2 and a molecular weight of 345.60 g/mol. Its IUPAC name is [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol
PubChem CID28825760
Molecular FormulaC14H11BrClFO2
Molecular Weight345.60 g/mol
Exact Mass343.96
IUPAC Name[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cc(Br)ccc1OCc1ccc(F)cc1Cl
InChIInChI=1S/C14H11BrClFO2/c15-11-2-4-14(10(5-11)7-18)19-8-9-1-3-12(17)6-13(9)16/h1-6,18H,7-8H2
InChIKeyINBGLQWJJZATNV-UHFFFAOYSA-N
XLogP4.31
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.60
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]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-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanamine
CID 60879629
[2-[(4-bromo-2-chlorophenyl)methoxy]-5-fluorophenyl]methanamine
CID 107694697
(2R)-N-[[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methyl]butan-2-amine
CID 51993891
2-[[4-bromo-2-(bromomethyl)phenoxy]methyl]-1-chloro-4-fluorobenzene
CID 102616579
1-[[4-bromo-2-(chloromethyl)phenoxy]methyl]-2,4-dichlorobenzene
CID 28981500
2-bromo-1-[[4-bromo-2-(chloromethyl)phenoxy]methyl]-4-fluorobenzene
CID 28981493
[5-bromo-2-[(4-bromo-2-fluorophenoxy)methyl]phenyl]methanol
CID 89437129
[5-bromo-2-[(3-bromo-5-fluorophenyl)methoxy]phenyl]methanol
CID 79705698
2-[5-bromo-2-[(2-chloro-5-fluorophenyl)methoxy]phenyl]ethanamine
CID 102619479
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
CID 102616489
[5-bromo-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 78993100
[4-[[4-bromo-2-(hydroxymethyl)phenoxy]methyl]phenyl]methanol
CID 112630832

Frequently Asked Questions

What is the IUPAC name of [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol?
The IUPAC name of [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol (CID 28825760) is [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol?
The canonical SMILES for [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol is OCc1cc(Br)ccc1OCc1ccc(F)cc1Cl.
What is the InChIKey of [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol?
The InChIKey is INBGLQWJJZATNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClFO2/c15-11-2-4-14(10(5-11)7-18)19-8-9-1-3-12(17)6-13(9)16/h1-6,18H,7-8H2.
What are the key properties of [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol?
[5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol has a molecular weight of 345.60 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-bromo-2-[(2-chloro-4-fluorophenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 28825760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).