Isopropyl 2-(4-bromophenyl)-4-quinolinecarboxylate
Basic information
- CAS
356087-00-8- Standard SMILES
CC(C)OC(=O)c1cc(-c2ccc(Br)cc2)nc2ccccc12- InChIKey
LIEVNBPVLPFEEB-UHFFFAOYSA-N- Molecular formula
- C19H16BrNO2
- Average molar mass
- 370.2 g/mol
- Monoisotopic mass
- 369.03644
Names & identifiers
- Preferred name
- Isopropyl 2-(4-bromophenyl)-4-quinolinecarboxylate
- IUPAC
- propan-2-yl 2-(4-bromophenyl)quinoline-4-carboxylate
- English name
- SALOR-INT L210188-1EA
- Molecular formula
- C19H16BrNO2
- Molecular weight
- 370.24
Names & synonyms
356087-00-8isopropyl 2-(4-bromophenyl)-4-quinolinecarboxylateRefChem:792126632-412-7Isopropyl 2-(4-bromophenyl)quinoline-4-carboxylateOprea1_195252propan-2-yl 2-(4-bromophenyl)quinoline-4-carboxylateSTK359299AKOS003397685ST50884067methylethyl 2-(4-bromophenyl)quinoline-4-carboxylateSALOR-INT L210188-1EA
Database identifiers
- CAS
356087-00-8- PubChem CID
- 4586979
- EC Number
- 632-412-7
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-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.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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