Basic information
- CAS
436089-40-6- Standard SMILES
Cc1cc(C)c2nc(-c3ccccc3)c(C)c(C(=O)O)c2c1- InChIKey
OTGGVDIKLFZRPO-UHFFFAOYSA-N- Molecular formula
- C19H17NO2
- Average molar mass
- 291.3 g/mol
Names & identifiers
- Preferred name
- 3,6,8-Trimethyl-2-phenylquinoline-4-carboxylic acid
- IUPAC
- 3,6,8-trimethyl-2-phenylquinoline-4-carboxylic acid
- English name
- 3,6,8-Trimethyl-2-phenylquinoline-4-carboxylicacid
- Molecular formula
- C19H17NO2
- Molecular weight
- 291.34
Names & synonyms
3,6,8-trimethyl-2-phenylquinoline-4-carboxylic acid436089-40-6MFCD034201593,6,8-trimethyl-2-phenyl-quinoline-4-carboxylic Acid3,6,8-TRIMETHYL-2-PHENYLQUINOLINE-4-CARBOXYLICACIDALBB-000637BBL015352STK415408AKOS003234084SB68772NCGC00324833-01VS-04922
Show more names
4-Quinolinecarboxylic acid, 3,6,8-trimethyl-2-phenyl-
CS-0317817ST50894918H21014AB01320272-02
Database identifiers
- CAS
436089-40-6
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 404
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
Suppliers5 total
COMBI-BLOCKS[email protected]
常州欣特科化工有限公司-
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
MATRIX[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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