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2,5-Dichlorobenzenediazonium
CAS: 15470-55-0 | C6H3Cl2N2+
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
15470-55-0
Molecular Formula:
C6H3Cl2N2+
Molecular Mass:
174.01 g/mol
Names and Synonyms:
2,5-Dichlorobenzenediazonium
Benzenediazonium, 2,5-dichloro-
2,5-Dichlorobenzenediazonium
Fast Scarlet GG Salt
Diazol Scarlet 2Zh
Diazo Fast Scarlet GG
C.I. Azoic Diazo Component 3
Azoic Diazo Component 3
Scarlet Salt GG
Icho Salt Scarlet GG
Fast Scarlet GGS Base
Identifiers:
SMILES:
N#[N+]c1cc(Cl)ccc1Cl
InChI:
InChI=1S/C6H3Cl2N2/c7-4-1-2-5(8)6(3-4)10-9/h1-3H/q+1
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 | 174.01 g/mol | CAS Common Chemistry |
| 172.96677987609 g/mol | RDKit | |
| Canonical SMILES | N#[N+]C1=CC(Cl)=CC=C1Cl | CAS Common Chemistry |
| InChI | InChI=1S/C6H3Cl2N2/c7-4-1-2-5(8)6(3-4)10-9/h1-3H/q+1 | CAS Common Chemistry |
| InChI Key | InChIKey=MPHSORCNUGSJAA-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2,5-Dichlorobenzenediazonium | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 28.15 Ų | RDKit |
| LogP | 3.4779800000000005 | RDKit |
| Molar Refractivity | 41.20600000000001 | RDKit |
