1-Hydroxy-4'-nitro-2-naphthanilide
Basic information
- CAS
68352-27-2- Standard SMILES
O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1O- InChIKey
HDZNXUFSRGJXLN-UHFFFAOYSA-N- Molecular formula
- C17H12N2O4
- Average molar mass
- 308.29 g/mol
- Monoisotopic mass
- 308.07970687
Names & identifiers
- Preferred name
- 1-Hydroxy-4'-nitro-2-naphthanilide
- IUPAC
- 1-hydroxy-N-(4-nitrophenyl)naphthalene-2-carboxamide
- English name
- 1-Hydroxy-4'-nitro-2-naphthanilide
- Molecular formula
- C17H12N2O4
- Molecular weight
- 308.29
Names & synonyms
1-HYDROXY-4'-NITRO-2-NAPHTHANILIDE68352-27-2RefChem:433125653-020-21-hydroxy-N-(4-nitrophenyl)naphthalene-2-carboxamide1-Hydroxy-N-(4-nitrophenyl)-2-naphthamideCHEMBL2441152SCHEMBL14428339AKOS0243333522-Naphthalenecarboxamide, 1-hydroxy-N-(4-nitrophenyl)-
Database identifiers
- CAS
68352-27-2- PubChem CID
- 3352872
- ChEMBL
CHEMBL2441152- EC Number
- 653-020-2
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 442
Physicochemical properties
- Melting point
- 225 °C · 225 °C
- Boiling point
- 465.5 · 465.5±30.0 °C(Predicted)
- Density
- 1.449 · 1.449±0.06 g/cm3(Predicted)
- pka
- 8.11 · 8.11±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 319 · H319-H400
- Precautionary statements
- 273 · P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, 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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H319-H400
- Precautionary statements
- P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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