2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene

C14H11Br2FO2 — CID 83233054

IUPAC2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene
SMILESCOc1ccc(Br)cc1COc1ccc(F)c(Br)c1
InChIInChI=1S/C14H11Br2FO2/c1-18-14-5-2-10(15)6-9(14)8-19-11-3-4-13(17)12(16)7-11/h2-7H,8H2,1H3
InChIKeyFXCFMHLBUUMMBK-UHFFFAOYSA-N
MW390.05 g/mol
LogP4.94
Rot. Bonds4

About 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene

2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene (PubChem CID 83233054) has the molecular formula C14H11Br2FO2 and a molecular weight of 390.05 g/mol. Its IUPAC name is 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene.

Molecular Properties

Compound Name2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene
PubChem CID83233054
Molecular FormulaC14H11Br2FO2
Molecular Weight390.05 g/mol
Exact Mass387.91
IUPAC Name2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene
SMILESCOc1ccc(Br)cc1COc1ccc(F)c(Br)c1
InChIInChI=1S/C14H11Br2FO2/c1-18-14-5-2-10(15)6-9(14)8-19-11-3-4-13(17)12(16)7-11/h2-7H,8H2,1H3
InChIKeyFXCFMHLBUUMMBK-UHFFFAOYSA-N
XLogP4.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.05
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-4-[(5-bromo-2-fluorophenyl)methoxy]-1-fluorobenzene
CID 83233544
2-bromo-1-[(5-bromo-2-fluorophenyl)methoxy]-4-methoxybenzene
CID 104707288
4-bromo-1-methoxy-2-[(3-methoxyphenoxy)methyl]benzene
CID 60666586
3-[(3-bromo-4-fluorophenoxy)methyl]-4-methoxybenzoic acid
CID 83232551
4-[(5-bromo-2-methoxyphenyl)methoxy]phenol
CID 54971308
2-[(5-bromo-2-methoxyphenyl)methoxy]-1,4-difluorobenzene
CID 63458235
3-[(5-bromo-2-methoxyphenyl)methoxy]-1,2,4,5-tetrafluorobenzene
CID 103289758
2-bromo-4-[(4-bromophenyl)methoxy]-1-fluorobenzene
CID 83231614
5-[(3-bromo-4-fluorophenoxy)methyl]-2-methoxyaniline
CID 83233823
4-bromo-2-[(3-ethylphenoxy)methyl]-1-methoxybenzene
CID 63457370
5-[(5-bromo-2-methoxyphenyl)methoxy]-2-chloro-1,3-dimethylbenzene
CID 63458388
2-bromo-4-[(2-bromophenyl)methoxy]-1-fluorobenzene
CID 83232064

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene?
The IUPAC name of 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene (CID 83233054) is 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene.
What is the SMILES notation for 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene?
The canonical SMILES for 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene is COc1ccc(Br)cc1COc1ccc(F)c(Br)c1.
What is the InChIKey of 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene?
The InChIKey is FXCFMHLBUUMMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2FO2/c1-18-14-5-2-10(15)6-9(14)8-19-11-3-4-13(17)12(16)7-11/h2-7H,8H2,1H3.
What are the key properties of 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene?
2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene has a molecular weight of 390.05 g/mol, XLogP of 4.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-[(5-bromo-2-methoxyphenyl)methoxy]-1-fluorobenzene is sourced from PubChem (CID 83233054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).