[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol

C13H9Br2FO2 — CID 64720660

IUPAC[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol
SMILESOCc1ccc(Oc2ccc(Br)cc2Br)c(F)c1
InChIInChI=1S/C13H9Br2FO2/c14-9-2-4-12(10(15)6-9)18-13-3-1-8(7-17)5-11(13)16/h1-6,17H,7H2
InChIKeyCGGQGWSTHFWDNZ-UHFFFAOYSA-N
MW376.02 g/mol
LogP4.64
Rot. Bonds3

About [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol

[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol (PubChem CID 64720660) has the molecular formula C13H9Br2FO2 and a molecular weight of 376.02 g/mol. Its IUPAC name is [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol.

Molecular Properties

Compound Name[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol
PubChem CID64720660
Molecular FormulaC13H9Br2FO2
Molecular Weight376.02 g/mol
Exact Mass373.90
IUPAC Name[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol
SMILESOCc1ccc(Oc2ccc(Br)cc2Br)c(F)c1
InChIInChI=1S/C13H9Br2FO2/c14-9-2-4-12(10(15)6-9)18-13-3-1-8(7-17)5-11(13)16/h1-6,17H,7H2
InChIKeyCGGQGWSTHFWDNZ-UHFFFAOYSA-N
XLogP4.64
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.02
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(4-bromo-3-fluorophenoxy)-3-fluorophenyl]methanol
CID 65201220
[4-(2,4-dibromophenoxy)phenyl]methanol
CID 64720453
2,4-dibromo-1-[2-bromo-4-(bromomethyl)phenoxy]benzene
CID 114062644
2-[4-(4-bromo-2-fluorophenoxy)-3-fluorophenyl]ethanamine
CID 55238749
[3-bromo-4-(2-bromo-4-chlorophenoxy)phenyl]methanol
CID 114062434
[4-(2,4-dibromophenoxy)-3,5-difluorophenyl]methanamine
CID 64720890
4-(2,4-dibromophenoxy)-3-fluorobenzaldehyde
CID 64720224
[4-(3,5-difluorophenoxy)-3-fluorophenyl]methanol
CID 55112239
(3-fluoro-4-phenoxyphenyl)methanol
CID 28946102
[4-(4-bromo-2-propan-2-ylphenoxy)-3,5-difluorophenyl]methanol
CID 115402414
1-[4-(2,4-dibromophenoxy)-3-fluorophenyl]ethanamine
CID 64719989
[6-(4-bromo-2-fluorophenoxy)-5-chloro-3-pyridinyl]methanol
CID 61257547

Frequently Asked Questions

What is the IUPAC name of [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol?
The IUPAC name of [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol (CID 64720660) is [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol.
What is the SMILES notation for [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol?
The canonical SMILES for [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol is OCc1ccc(Oc2ccc(Br)cc2Br)c(F)c1.
What is the InChIKey of [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol?
The InChIKey is CGGQGWSTHFWDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2FO2/c14-9-2-4-12(10(15)6-9)18-13-3-1-8(7-17)5-11(13)16/h1-6,17H,7H2.
What are the key properties of [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol?
[4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol has a molecular weight of 376.02 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,4-dibromophenoxy)-3-fluorophenyl]methanol is sourced from PubChem (CID 64720660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).