N-(3-Chloro-4-methylphenyl)-3,4-dihydro-1(2H)-quinolinecarboxamide
Basic information
- CAS
853319-15-0- Standard SMILES
Cc1ccc(NC(=O)N2CCCc3ccccc32)cc1Cl- InChIKey
ZSPBOPUKRXELMU-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O
- Average molar mass
- 300.8 g/mol
- Monoisotopic mass
- 300.1029409
Names & identifiers
- Preferred name
- N-(3-Chloro-4-methylphenyl)-3,4-dihydro-1(2H)-quinolinecarboxamide
- IUPAC
- N-(3-chloro-4-methylphenyl)-3,4-dihydro-2H-quinoline-1-carboxamide
- English name
- N-(3-chloro-4-methylphenyl)-1,2,3,4-tetrahydroquinoline-1-carboxamide
- Molecular formula
- C17H17ClN2O
- Molecular weight
- 300.78268
Names & synonyms
853319-15-0N-(3-chloro-4-methylphenyl)-3,4-dihydro-1(2H)-quinolinecarboxamideRefChem:826380661-766-5N-(3-Chloro-4-methylphenyl)-3,4-dihydroquinoline-1(2H)-carboxamideAKOS024328103N-(3-chloro-4-methylphenyl)-1,2,3,4-tetrahydroquinoline-1-carboxamide
Database identifiers
- CAS
853319-15-0- PubChem CID
- 45051169
- EC Number
- 661-766-5
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Physicochemical properties
- Symbol(GHS)
- 9 · GHS09
- Hazard statements
- 411 · H411
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
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 2 (100%)
Safety data
- Symbol(GHS)
- GHS09
- Hazard statements
- H411
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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