8-Bromoquinoline-5-carbaldehyde
Basic information
- CAS
943847-26-5- Standard SMILES
O=Cc1ccc(Br)c2ncccc12- InChIKey
NIOXYAINOJNOLA-UHFFFAOYSA-N- Molecular formula
- C10H6BrNO
- Average molar mass
- 236.06 g/mol
- Monoisotopic mass
- 234.96328
Names & identifiers
- Preferred name
- 8-Bromoquinoline-5-carbaldehyde
- IUPAC
- 8-bromoquinoline-5-carbaldehyde
- English name
- 8-Bromo-quinoline-5-carbaldehyde
- Molecular formula
- C10H6BrNO
- Molecular weight
- 236.06
Names & synonyms
8-Bromoquinoline-5-carbaldehyde943847-26-5SCHEMBL10386048-bromo-5-quinolinecarboxaldehydeNIOXYAINOJNOLA-UHFFFAOYSA-NMFCD19288133SY462833F84617EN300-8159647F982857Z12691544978-Bromo-quinoline-5-carbaldehyde
Show more names
5-Quinolinecarboxaldehyde, 8-bromo-
Database identifiers
- CAS
943847-26-5- PubChem CID
- 86645280
- EC Number
- 885-485-4
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 197
Physicochemical properties
- Boiling point
- 374.6 · 374.6±27.0 °C(Predicted)
- Density
- 1.632 · 1.632±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- pka
- 1.3 · 1.30±0.29(Predicted)
- Appearance
- Yellow to orange Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
5 records
Compound notes
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