N-(4-chlorobenzyl)-1-naphthamide
Basic information
- CAS
549486-97-7- Standard SMILES
O=C(NCc1ccc(Cl)cc1)c1cccc2ccccc12- InChIKey
JTOKHCCLFPKMFM-UHFFFAOYSA-N- Molecular formula
- C18H14ClNO
- Average molar mass
- 295.8 g/mol
- Monoisotopic mass
- 295.0763918
Names & identifiers
- Preferred name
- N-(4-chlorobenzyl)-1-naphthamide
- IUPAC
- N-[(4-chlorophenyl)methyl]naphthalene-1-carboxamide
- English name
- N-[(4-chlorophenyl)methyl]naphthalene-1-carboxamide
- Molecular formula
- C18H14ClNO
- Molecular weight
- 295.76
Names & synonyms
N-(4-chlorobenzyl)-1-naphthamideN-[(4-Chlorophenyl)methyl]-1-naphthalenecarboxamide549486-97-7N-[(4-chlorophenyl)methyl]naphthalene-1-carboxamideSTL289931AKOS003847866N-(4-chlorobenzyl)naphthalene-1-carboxamideAG-690/111424651-Naphthalenecarboxamide, N-[(4-chlorophenyl)methyl]-
Database identifiers
- CAS
549486-97-7- PubChem CID
- 4132834
- EC Number
- 140-869-4
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Boiling point
- 541.6 · 541.6±33.0 °C(Predicted)
- Density
- 1.25 · 1.250±0.06 g/cm3(Predicted)
- pka
- 13.76 · 13.76±0.46(Predicted)
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, P391, 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. 4 (100%)
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Related reactions
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Compound notes
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