5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde

C14H8Br2O2 — CID 11326094

IUPAC5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde
SMILESO=Cc1cc(Br)ccc1-c1ccc(Br)cc1C=O
InChIInChI=1S/C14H8Br2O2/c15-11-1-3-13(9(5-11)7-17)14-4-2-12(16)6-10(14)8-18/h1-8H
InChIKeyCPFJSEXQJQDJRT-UHFFFAOYSA-N
MW368.02 g/mol
LogP4.50
Rot. Bonds3

About 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde

5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde (PubChem CID 11326094) has the molecular formula C14H8Br2O2 and a molecular weight of 368.02 g/mol. Its IUPAC name is 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde.

Molecular Properties

Compound Name5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde
PubChem CID11326094
Molecular FormulaC14H8Br2O2
Molecular Weight368.02 g/mol
Exact Mass365.89
IUPAC Name5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde
SMILESO=Cc1cc(Br)ccc1-c1ccc(Br)cc1C=O
InChIInChI=1S/C14H8Br2O2/c15-11-1-3-13(9(5-11)7-17)14-4-2-12(16)6-10(14)8-18/h1-8H
InChIKeyCPFJSEXQJQDJRT-UHFFFAOYSA-N
XLogP4.50
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.02
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

4,4'-Dibromobenzil
CID 96430
3-Bromobenzaldehyde
CID 76583
4-Bromobenzaldehyde
CID 70741
4-Bromobenzophenone
CID 7030
(1,1'-Biphenyl)-2,2'-dicarboxaldehyde
CID 14585
6-Bromo-1,2-naphthoquinone
CID 23384
4,4'-Dibromobenzophenone
CID 72868
2-Bromo-9-fluorenone
CID 725831
4'-Bromochalcone
CID 5355204
4-Bromochalcone
CID 5367147
(2E)-1-(3-Bromophenyl)-3-phenylprop-2-en-1-one
CID 5801435
3,6-Dibromophenanthrene-9,10-quinone
CID 258450

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde?
The IUPAC name of 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde (CID 11326094) is 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde.
What is the SMILES notation for 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde?
The canonical SMILES for 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde is O=Cc1cc(Br)ccc1-c1ccc(Br)cc1C=O.
What is the InChIKey of 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde?
The InChIKey is CPFJSEXQJQDJRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Br2O2/c15-11-1-3-13(9(5-11)7-17)14-4-2-12(16)6-10(14)8-18/h1-8H.
What are the key properties of 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde?
5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde has a molecular weight of 368.02 g/mol, XLogP of 4.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-bromo-2-formylphenyl)benzaldehyde is sourced from PubChem (CID 11326094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).