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Monochrome Yellow 1 Sodium Salt

CAS: 584-42-9 | C13H9N3NaO5

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number: 584-42-9
Molecular Formula: C13H9N3NaO5
Molecular Weight: 310.22100000000006 g/mol

Names and Synonyms:

Monochrome Yellow 1 Sodium Salt
Chrome Fast Yellow RW
Calcochrome Yellow 2G
Azochromol Yellow 5G
Atlantichrome Yellow 2G
Anthranol Chrome Yellow 5GS
Anthranol Chrome Yellow 2G
Alizarol Yellow GW
Alizarin Yellow
Alizarine Yellow GR
Alizarine Yellow GM
Alizarine Yellow GGW
Alizarine Yellow AGP
Alizarine Yellow G
Alizarine Yellow 2G
Acid Chrome Yellow GG
Acid Chrome Yellow 2GW
C.I. 14025
Salicylic acid, 5-(m-nitrophenylazo)-, sodium salt
C.I. Mordant Yellow 1
Benzoic acid, 2-hydroxy-5-[(3-nitrophenyl)azo]-, monosodium salt
C.I. Mordant Yellow 1, monosodium salt
Benzoic acid, 2-hydroxy-5-[2-(3-nitrophenyl)diazenyl]-, sodium salt (1:1)
Monochrome Yellow 1 sodium salt
Alizarine Yellow Zh
Alizarine Yellow ZhZh
Salicylic acid, (m-nitrophenylazo)-, sodium salt
Alizarin Yellow G sodium salt
Alizarin Yellow GG
Alizarine Yellow GG
Eriochrome Yellow GS
Metachrome Yellow
Alizarin Yellow G
Sodium 5-[(3-nitrophenyl)azo]salicylate
Sodium 5-(m-nitrophenylazo)salicylate
RV 1
Yodochrome Yellow GGN
Sunchromine Yellow GG
Solochrome Yellow WN
Sodium m-nitrobenzeneazosalicylate
Showa Chrome Yellow GG
Salicyl yellow
Pontachrome Yellow GS
Orthochrome Yellow GGW
Monochrome Yellow MG
Mitsui Chrome Yellow GG
Metomega Chrome Yellow GM
Metachrome Yellow RA
Magracrom Yellow GG
Kayaku Mordant Yellow GG
Java Unichrome Yellow GT
Java Chrome Yellow GT
Hispacrom Yellow 2GR
Hispacrom Yellow 2G
Hidachrome Yellow 2G
Fenakrom Yellow R
Eriochrome Yellow 2G
Eriochromal Yellow 2G
Eniacromo Yellow G
Cromal Yellow M
Chromol Yellow N
Chromol Yellow G
Chrome Yellow 2GR
Chrome Yellow 2G

Identifiers:

SMILES:
O=C(O)c1cc(N=Nc2cccc([N+](=O)[O-])c2)ccc1O.[Na]
InChI:
InChI=1S/C13H9N3O5.Na/c17-12-5-4-9(7-11(12)13(18)19)15-14-8-2-1-3-10(6-8)16(20)21;/h1-7,17H,(H,18,19);

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

Physical Properties

Property Value Source
molecular_mass 310.22 g/mol Legacy Database
cas-canonical-smile [Na].O=C(O)C1=CC(N=NC2=CC=CC(=C2)N(=O)=O)=CC=C1O None Legacy Database
cas-inchi InChI=1S/C13H9N3O5.Na/c17-12-5-4-9(7-11(12)13(18)19)15-14-8-2-1-3-10(6-8)16(20)21;/h1-7,17H,(H,18,19); None Legacy Database
cas-inchi-key InChIKey=MIUNFDBDKWAGRK-UHFFFAOYSA-N None Legacy Database
cas-name Monochrome Yellow 1 sodium salt None Legacy Database
LogP 3.0332000000000012 RDKit

Molecular

Property Value Source
Molecular Weight 310.22100000000006 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 310.04398966800005 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 22 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 6 count RDKit
Hydrogen Bond Donors 2 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 4 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 2 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 125.39 Ų RDKit

Molar

Property Value Source
Molar Refractivity 78.09250000000002 RDKit

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