Dibromoacetaldehyde
Basic information
- CAS
3039-13-2- Standard SMILES
O=CC(Br)Br- InChIKey
XIVPMNIFAAGBOY-UHFFFAOYSA-N- Molecular formula
- C2H2Br2O
- Average molar mass
- 201.84 g/mol
- Monoisotopic mass
- 199.84724
Overview
2,2-Dibromoethanal has been reported in Asparagopsis armata with data available.
Names & identifiers
- Preferred name
- Dibromoacetaldehyde
- IUPAC
- 2,2-dibromoacetaldehyde
- English name
- DIBROMOACETALDEHYDE
- Molecular formula
- C2H2Br2O
- Molecular weight
- 201.84
Names & synonyms
DIBROMOACETALDEHYDE2,2-dibromoacetaldehyde3039-13-2Acetaldehyde, dibromo-dibromacetaldehydSCHEMBL620413orb1690630SCHEMBL3897423DTXSID60184476XIVPMNIFAAGBOY-UHFFFAOYSA-Ndibromoacetaldehyde (technical grade)AKOS040758028
Show more names
Acetaldehyde, 2,2-dibromo-
FD172168DB-342557HY-133647CS-0128473T40382EN300-2287794
Database identifiers
- CAS
3039-13-2- PubChem CID
- 18223
- DTXSID
DTXSID60184476- Nikkaji
- J80.624B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 34.6
Physicochemical properties
- Melting point
- 87 °C · >87°C (dec.)
- Boiling point
- 137 · 137-140 °C
- Density
- 2.357 · 2.357±0.06 g/cm3(Predicted)
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- DMSO (Very Slightly), Methanol (Slightly, Heated)
- form
- Solid
- color
- White to Pale Orange
- Stability
- Extremely Moisture Sensitive, Hygroscopic
Chemistry & industry
Applications
UsesDibromoacetaldehyde is used in analytical studies for micro liquid-liquid extraction combined with large volume injection gas chromatography-mass spectrometry for determination of haloacetaldehydes in treated water.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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