Basic information
- CAS
350999-95-0- Standard SMILES
CCOc1cccc(-c2cc(C(=O)O)c3cc(Br)ccc3n2)c1- InChIKey
VNGWIIJCZIVDNZ-UHFFFAOYSA-N- Molecular formula
- C18H14BrNO3
- Average molar mass
- 372.2 g/mol
- Monoisotopic mass
- 371.01571
Names & identifiers
- Preferred name
- 6-Bromo-2-(3-ethoxyphenyl)quinoline-4-carboxylic acid
- IUPAC
- 6-bromo-2-(3-ethoxyphenyl)quinoline-4-carboxylic acid
- English name
- 6-BROMO-2-(3-ETHOXYPHENYL)QUINOLINE-4-CARBOXYLIC ACID
- Molecular formula
- C18H14BrNO3
- Molecular weight
- 372.21
Names & synonyms
6-bromo-2-(3-ethoxyphenyl)quinoline-4-carboxylic acid350999-95-0DTXSID50359757RefChem:307391DTXCID20310810MFCD01923322Oprea1_1477056-Bromo-2-(3-ethoxy-phenyl)-quinoline-4-carboxylic acidHMS5170P01ALBB-000458BBL013717STK330766
Show more names
AK-968/410178056-bromo-2-(3-ethoxyphenyl)cinchoninic acid4-Quinolinecarboxylic acid, 6-bromo-2-(3-ethoxyphenyl)-
AKOS001699077SB72263VS-03958DB-069120CS-0316113EU-0050035ST50927992H20855
Database identifiers
- CAS
350999-95-0- PubChem CID
- 994641
- DTXSID
DTXSID50359757
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 419
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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