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Basic information
- CAS
103914-79-0- Standard SMILES
NC(=O)c1c[nH]c2ccccc2c1=O
Names & identifiers
- Preferred name
- 4-Oxo-1,4-dihydroquinoline-3-carboxamide
Database identifiers
- CAS
103914-79-0- PubChem CID
- 824670
- ChEBI
CHEBI:207725- EC Number
- 890-871-0
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 72.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 309
Safety & regulation
GHS classification
GHS Classification
Warning
H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P301+P317, 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 CategoriesAcute Tox. 5 (100%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
Related reactions
2 records
Compound notes
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