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Molecule
N-Phenyl-2-Naphthylamine
CAS: 135-88-6 · C16H13N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 135-88-6
- Molecular Formula
- C16H13N
- Molecular Mass
- 219.29 g/mol
Identifiers
CAS Registry Number
135-88-6
SMILES
c1ccc(Nc2ccc3ccccc3c2)cc1
InChI Key
KEQFTVQCIQJIQW-UHFFFAOYSA-N
InChI
InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H
Names and Synonyms
- N-Phenyl-2-Naphthylamine Synonym
- 2-Naphthalenamine, N-phenyl- Synonym
- 2-Naphthylamine, N-phenyl- Synonym
- N-Phenyl-2-naphthalenamine Synonym
- Aceto PBN Synonym
- AgeRite Powder Synonym
- 2-Anilinonaphthalene Synonym
- N-(2-Naphthyl)aniline Synonym
- Neosone D Synonym
- Neozone D Synonym
- PBNA Synonym
- 2-(Phenylamino)naphthalene Synonym
- Phenyl-2-naphthylamine Synonym
- Neozone Synonym
- Nilox PBNA Synonym
- Neozon D Synonym
- 2-Naphthylphenylamine Synonym
- β-Naphthylphenylamine Synonym
- Stabilizator AR Synonym
- Nonox D Synonym
- Phenyl-β-naphthylamine Synonym
- N-Phenyl-β-naphthylamine Synonym
- Antioxidant PBN Synonym
- Antioxidant 116 Synonym
- Vulkanox PBN Synonym
- Nonox DN Synonym
- N-Phenyl-2-naphthylamine Synonym
- N-(2-Naphthyl)-N-phenylamine Synonym
- Stabilizer AR Synonym
- Antioxidant D Synonym
- Nocrac D Synonym
- Naftam 2 Synonym
- N-β-Naphthyl-N-phenylamine Synonym
- PNA Synonym
- AK 1 (stabilizer) Synonym
- AK 1 Synonym
- Noclizer D Synonym
- N-Phenyl-N-(2-naphthyl)amine Synonym
- NSC 37151 Synonym
- N-Phenylnaphthalene-2-amine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 219.29 g/mol | CAS Common Chemistry |
| 219.287 g/mol | RDKit | |
| Density | 1.24 g/cm³ | CAS Common Chemistry |
| 1.24 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 395.5 °C | CAS Common Chemistry |
| Canonical SMILES | C=1C=CC(=CC1)NC=2C=CC=3C=CC=CC3C2 | CAS Common Chemistry |
| InChI | InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H | CAS Common Chemistry |
| InChI Key | InChIKey=KEQFTVQCIQJIQW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 108 °C | CAS Common Chemistry |
| Name | N-Phenyl-2-naphthylamine | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 3 | RDKit |
| Topological Polar Surface Area | 12.03 Ų | RDKit |
| LogP | 4.583400000000002 | RDKit |
| 4.5834 | RDKit | |
| Molar Refractivity | 73.67270000000005 cm³/mol | RDKit |
| Ring Count | 3 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 219.104799416 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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Quick conversion
MW = 219.29 g/mol; density = 1.240 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C16H13N.
