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3-Hydroxy-N-1-Naphthalenyl-2-Naphthalenecarboxamide
CAS: 132-68-3 | C21H15NO2
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
132-68-3
Molecular Formula:
C21H15NO2
Molecular Mass:
313.36 g/mol
Names and Synonyms:
3-Hydroxy-N-1-Naphthalenyl-2-Naphthalenecarboxamide
Sanatol BO
2-Naphthalenecarboxamide, 3-hydroxy-N-1-naphthalenyl-
2-Naphthamide, 3-hydroxy-N-1-naphthyl-
3-Hydroxy-N-1-naphthalenyl-2-naphthalenecarboxamide
C.I. 37560
Acco Naphthol AS-BO
Acna Naphthol F
Amanil Naphthol AS-BO
Amarthol AS-BO
Anthonaphthol M 3B
Azonaphtol AN
Azotol ANF
Brenthol AN
Celcot RN
Cibanaphthol RN
C.I. Azoic Coupling Component 4
Dragonthol BO
Hiltonaphthol AS-BO
Mitsui Naphthozol BO
Naftolo MBO
Naphtanilide BO
Naphtanilide BO Supra
Naphtazol 3B
Naphthoide BO
Naphthol ACNA F
Naphthol AS-BO
N-(1-Naphthyl)-3-hydroxy-2-naphthamide
Naphtoelan BO
Naphtol AS-BO
Naphtol AS-BOLL
Solunaptol ANL
Tulathol AS-BO
Ultrazol VII-BO
3-Hydroxy-N-1-naphthyl-2-naphthamide
2-Hydroxynaphthalene-3-carboxylic acid α-naphthylamide
Naphthol BO
Azoic Coupling Component 4
2-Hydroxy-3-naphthoic acid α-naphthylamide
NSC 37202
Conazoic D
Naftol AS-BS
Dycosthol AS-BO
Hebeithol AS-BO
Kiwa Grounder BO
Anarthol AS-BO
Napthol ASBO
3-Hydroxy-N-(1-naphthyl)-2-naphthoamide
3-Hydroxy-naphthalene-2-carboxylic acid naphthalen-1-ylamide
3-Hydroxy-N-(naphthalen-1-yl)-2-naphthamide
Identifiers:
SMILES:
OC(=Nc1cccc2ccccc12)c1cc2ccccc2cc1O
InChI:
InChI=1S/C21H15NO2/c23-20-13-16-8-2-1-7-15(16)12-18(20)21(24)22-19-11-5-9-14-6-3-4-10-17(14)19/h1-13,23H,(H,22,24)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 313.36 g/mol | CAS Common Chemistry |
| 313.35600000000005 g/mol | RDKit | |
| 313.11027872 g/mol | RDKit | |
| Canonical SMILES | O=C(NC1=CC=CC=2C=CC=CC21)C3=CC=4C=CC=CC4C=C3O | CAS Common Chemistry |
| InChI | InChI=1S/C21H15NO2/c23-20-13-16-8-2-1-7-15(16)12-18(20)21(24)22-19-11-5-9-14-6-3-4-10-17(14)19/h1-13,23H,(H,22,24) | CAS Common Chemistry |
| InChI Key | InChIKey=QGZGJNPVHADCFM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 3-Hydroxy-N-1-naphthalenyl-2-naphthalenecarboxamide | CAS Common Chemistry |
| Heavy Atom Count | 24 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 4 | RDKit |
| Topological Polar Surface Area | 52.82000000000001 Ų | RDKit |
| LogP | 5.334900000000004 | RDKit |
| Molar Refractivity | 98.38660000000003 | RDKit |
