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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 Weight: 313.35600000000005 g/mol

Names and Synonyms:

3-Hydroxy-N-1-Naphthalenyl-2-Naphthalenecarboxamide
3-Hydroxy-N-(naphthalen-1-yl)-2-naphthamide
3-Hydroxy-naphthalene-2-carboxylic acid naphthalen-1-ylamide
3-Hydroxy-N-(1-naphthyl)-2-naphthoamide
Napthol ASBO
Anarthol AS-BO
Kiwa Grounder BO
Hebeithol AS-BO
Dycosthol AS-BO
Naftol AS-BS
Conazoic D
NSC 37202
2-Hydroxy-3-naphthoic acid α-naphthylamide
Azoic Coupling Component 4
Naphthol BO
2-Hydroxynaphthalene-3-carboxylic acid α-naphthylamide
3-Hydroxy-N-1-naphthyl-2-naphthamide
Ultrazol VII-BO
Tulathol AS-BO
Solunaptol ANL
Naphtol AS-BOLL
Naphtol AS-BO
Naphtoelan BO
N-(1-Naphthyl)-3-hydroxy-2-naphthamide
Naphthol AS-BO
Naphthol ACNA F
Naphthoide BO
Naphtazol 3B
Naphtanilide BO Supra
Naphtanilide BO
Naftolo MBO
Mitsui Naphthozol BO
Hiltonaphthol AS-BO
Dragonthol BO
C.I. Azoic Coupling Component 4
Cibanaphthol RN
Celcot RN
Brenthol AN
Azotol ANF
Azonaphtol AN
Anthonaphthol M 3B
Amarthol AS-BO
Amanil Naphthol AS-BO
Acna Naphthol F
Acco Naphthol AS-BO
C.I. 37560
3-Hydroxy-N-1-naphthalenyl-2-naphthalenecarboxamide
2-Naphthamide, 3-hydroxy-N-1-naphthyl-
2-Naphthalenecarboxamide, 3-hydroxy-N-1-naphthalenyl-
Sanatol BO

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.

External Resources

All Properties

Comprehensive physical and chemical properties

Molecular

Property Value Source
Molecular Weight 313.35600000000005 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 313.11027872 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 24 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 2 count RDKit
Hydrogen Bond Donors 2 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 2 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 4 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 52.82000000000001 Ų RDKit

Physical Properties

Property Value Source
LogP 5.334900000000004 RDKit
molecular_mass 313.36 g/mol Legacy Database
cas-canonical-smile O=C(NC1=CC=CC=2C=CC=CC21)C3=CC=4C=CC=CC4C=C3O None Legacy Database
cas-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) None Legacy Database
cas-inchi-key InChIKey=QGZGJNPVHADCFM-UHFFFAOYSA-N None Legacy Database
cas-name 3-Hydroxy-N-1-naphthalenyl-2-naphthalenecarboxamide None Legacy Database

Molar

Property Value Source
Molar Refractivity 98.38660000000003 RDKit

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