5-Bromo-6-chloro-3-pyridinecarboxaldehyde
Basic information
- CAS
71702-00-6- Standard SMILES
O=Cc1cnc(Cl)c(Br)c1- InChIKey
JUMZDNQKFRBLAB-UHFFFAOYSA-N- Molecular formula
- C6H3BrClNO
- Average molar mass
- 220.45 g/mol
- Monoisotopic mass
- 218.90865
Names & identifiers
- Preferred name
- 5-Bromo-6-chloro-3-pyridinecarboxaldehyde
- IUPAC
- 5-bromo-6-chloropyridine-3-carbaldehyde
- English name
- 5-BroMo-6-chloronicotinaldehyde
- Molecular formula
- C6H3BrClNO
- Molecular weight
- 220.45
Names & synonyms
71702-00-65-BROMO-6-CHLORO-3-PYRIDINECARBOXALDEHYDERefChem:3019445-Bromo-6-chloronicotinaldehyde5-bromo-6-chloropyridine-3-carbaldehyde5-BROMO-6-CHLORO-PYRIDINE-3-CARBALDEHYDEMFCD11845760SCHEMBL7101112SCHEMBL30499193JUMZDNQKFRBLAB-UHFFFAOYSA-NDTXSID8012728143-bromo-2-chloro-5-formylpyridine
Show more names
3-Pyridinecarboxaldehyde, 5-bromo-6-chloro-
WCA70200SBB052260AKOS008901413AB64592AS-5554DB-122589CS-0268501G20133
Database identifiers
- CAS
71702-00-6- PubChem CID
- 22397261
- DTXSID
DTXSID801272814- EC Number
- 989-785-7
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Boiling point
- 296.2 · 296.2±35.0 °C(Predicted)
- Density
- 1.8 · 1.800±0.06 g/cm3(Predicted)
- pka
- -2.62 · -2.62±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 280 · P280-P301+P312-P362+P364
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P280-P301+P312-P362+P364
Suppliers
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Related reactions
6 records
Compound notes
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