Basic information
- CAS
96963-51-8- Standard SMILES
O=C(Nc1cccc2ccccc12)c1cccc(Cl)c1- InChIKey
BYFNQYKVOSWXND-UHFFFAOYSA-N- Molecular formula
- C17H12ClNO
- Average molar mass
- 281.7 g/mol
- Monoisotopic mass
- 281.0607417
Names & identifiers
- Preferred name
- 3-Chloro-N-(1-naphthyl)benzamide
- IUPAC
- 3-chloro-N-naphthalen-1-ylbenzamide
- English name
- 3-chloro-N-(1-naphthyl)benzamide
- Molecular formula
- C17H12ClNO
- Molecular weight
- 281.74
Names & synonyms
3-chloro-N-(1-naphthyl)benzamide96963-51-8RefChem:500363668-232-03-chloro-N-(naphthalen-1-yl)benzamide3-chloro-N-naphthalen-1-ylbenzamideSCHEMBL27388520STK205226AKOS003235009(3-chlorophenyl)-N-naphthylcarboxamideST45025030AE-848/32184029
Show more names
Reaxys ID: 5544189Benzamide, 3-chloro-N-1-naphthalenyl-
Database identifiers
- CAS
96963-51-8- PubChem CID
- 828071
- EC Number
- 668-232-0
- Nikkaji
- J1.885.120B
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 346
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
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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