2-(Naphthalen-2-yl)quinoline-4-carboxylic acid
Basic information
- CAS
13605-87-3- Standard SMILES
O=C(O)c1cc(-c2ccc3ccccc3c2)nc2ccccc12- InChIKey
LLMCWSJMTWWINZ-UHFFFAOYSA-N- Molecular formula
- C20H13NO2
- Average molar mass
- 299.3 g/mol
- Monoisotopic mass
- 299.09462866
Names & identifiers
- Preferred name
- 2-(Naphthalen-2-yl)quinoline-4-carboxylic acid
- IUPAC
- 2-naphthalen-2-ylquinoline-4-carboxylic acid
- English name
- 2-Naphthalen-2-yl-quinoline-4-carboxylic acid
- Molecular formula
- C20H13NO2
- Molecular weight
- 299.32
Names & synonyms
13605-87-32-(naphthalen-2-yl)quinoline-4-carboxylic acidDTXSID60350472RefChem:254443DTXCID503015392-Naphthalen-2-yl-quinoline-4-carboxylic acid2-naphthalen-2-ylquinoline-4-carboxylic acid2-(2-naphthyl)quinoline-4-carboxylic acidMFCD00622213CHEMBL3453004-Quinolinecarboxylic acid, 2-(2-naphthalenyl)-Oprea1_554721
Show more names
2-(2-naphthyl)cinchoninic acid2-(2-naphthyl)-4-quinolinecarboxylic acid2-(2-naphthalenyl)-4-quinolinecarboxylic acid
Oprea1_709918SCHEMBL1173872-Naphthylchinolin-4-carbonsaureALBB-011584BBL016804BDBM50097101STK435043AKOS001598328
Database identifiers
- CAS
13605-87-3- PubChem CID
- 680333
- DTXSID
DTXSID60350472- ChEMBL
CHEMBL345300- EC Number
- 673-272-7
- Nikkaji
- J1.508.423E
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 437
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- 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.
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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