Basic information
- CAS
355421-53-3- Standard SMILES
CC(OC(=O)c1cc(-c2ccc(Br)cc2)nc2ccc(Br)cc12)C(=O)c1ccccc1- InChIKey
GCMDAKZGYQKLIE-UHFFFAOYSA-N- Molecular formula
- C25H17Br2NO3
- Average molar mass
- 539.2 g/mol
- Monoisotopic mass
- 536.95752
Names & identifiers
- Preferred name
- 1-Methyl-2-oxo-2-phenylethyl 6-bromo-2-(4-bromophenyl)-4-quinolinecarboxylate
- IUPAC
- (1-oxo-1-phenylpropan-2-yl) 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate
- English name
- SALOR-INT L208019-1EA
- Molecular formula
- C25H17Br2NO3
- Molecular weight
- 539.22
Names & synonyms
355421-53-31-METHYL-2-OXO-2-PHENYLETHYL 6-BROMO-2-(4-BROMOPHENYL)-4-QUINOLINECARBOXYLATERefChem:434059632-496-51-oxo-1-phenylpropan-2-yl 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylateOprea1_420950STK269898AKOS003285455AKOS022063335UPCMLD0ENAT0507-5167:001ST50853958Z56824005
Show more names
SALOR-INT L208019-1EA4-Quinolinecarboxylic acid, 6-bromo-2-(4-bromophenyl)-, 1-methyl-2-oxo-2-phenylethyl ester
1-methyl-2-oxo-2-phenylethyl 6-bromo-2-(4-bromophenyl)quinoline-4-carboxylate
Database identifiers
- CAS
355421-53-3- PubChem CID
- 3731455
- EC Number
- 632-496-5
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 630
Physicochemical properties
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 413 · H413-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P405, 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. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H413-H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Suppliers4 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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