Back to Search
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.
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 |
