1,3-dibromo-2,4-dimethoxybenzene

C8H8Br2O2 — CID 11645053

IUPAC1,3-dibromo-2,4-dimethoxybenzene
SMILESCOc1ccc(Br)c(OC)c1Br
InChIInChI=1S/C8H8Br2O2/c1-11-6-4-3-5(9)8(12-2)7(6)10/h3-4H,1-2H3
InChIKeyUZFUWYMMUGVSCE-UHFFFAOYSA-N
MW295.96 g/mol
LogP3.23
Rot. Bonds2

About 1,3-dibromo-2,4-dimethoxybenzene

1,3-dibromo-2,4-dimethoxybenzene (PubChem CID 11645053) has the molecular formula C8H8Br2O2 and a molecular weight of 295.96 g/mol. Its IUPAC name is 1,3-dibromo-2,4-dimethoxybenzene.

Molecular Properties

Compound Name1,3-dibromo-2,4-dimethoxybenzene
PubChem CID11645053
Molecular FormulaC8H8Br2O2
Molecular Weight295.96 g/mol
Exact Mass293.89
IUPAC Name1,3-dibromo-2,4-dimethoxybenzene
SMILESCOc1ccc(Br)c(OC)c1Br
InChIInChI=1S/C8H8Br2O2/c1-11-6-4-3-5(9)8(12-2)7(6)10/h3-4H,1-2H3
InChIKeyUZFUWYMMUGVSCE-UHFFFAOYSA-N
XLogP3.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.96
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-dibromo-2,3-dimethoxybenzene
CID 15784959
1-bromo-3-chloro-2,4-dimethoxybenzene
CID 53217015
1-bromo-4-methoxynaphthalene;ethane
CID 143974048
1-bromo-2,4-dimethoxy-3-(methoxymethyl)benzene
CID 10989047
2,5-dibromo-8-methoxyquinoline
CID 102941160
(3-bromo-2,6-dimethoxyphenyl) acetate
CID 91102883
1-bromo-2,4-dimethoxy-3-prop-2-enylbenzene
CID 51033165
1-bromo-3,4-dimethoxy-2-methylsulfanylbenzene
CID 15692127
1-(3-bromo-2,4-dimethoxyphenyl)cyclopropan-1-amine
CID 84809618
2-bromo-1-(3-bromo-2,6-dimethoxyphenyl)ethanone
CID 102137910
1,2-dibromo-3-methoxybenzene
CID 11958056
3,6-dibromo-2-methoxybenzenethiol
CID 171002224

Frequently Asked Questions

What is the IUPAC name of 1,3-dibromo-2,4-dimethoxybenzene?
The IUPAC name of 1,3-dibromo-2,4-dimethoxybenzene (CID 11645053) is 1,3-dibromo-2,4-dimethoxybenzene.
What is the SMILES notation for 1,3-dibromo-2,4-dimethoxybenzene?
The canonical SMILES for 1,3-dibromo-2,4-dimethoxybenzene is COc1ccc(Br)c(OC)c1Br.
What is the InChIKey of 1,3-dibromo-2,4-dimethoxybenzene?
The InChIKey is UZFUWYMMUGVSCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Br2O2/c1-11-6-4-3-5(9)8(12-2)7(6)10/h3-4H,1-2H3.
What are the key properties of 1,3-dibromo-2,4-dimethoxybenzene?
1,3-dibromo-2,4-dimethoxybenzene has a molecular weight of 295.96 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dibromo-2,4-dimethoxybenzene is sourced from PubChem (CID 11645053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).