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Sodium Dichloroisocyanurate
CAS: 2893-78-9 | C3HCl2N3NaO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2893-78-9
Molecular Formula:
C3HCl2N3NaO3
Molecular Mass:
220.96 g/mol
Names and Synonyms:
Sodium Dichloroisocyanurate
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3-dichloro-, sodium salt (1:1)
s-Triazine-2,4,6(1H,3H,5H)-trione, 1,3-dichloro-, sodium salt
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3-dichloro-, sodium salt
ACL 60
Sodium dichlorocyanurate
Sodium dichloroisocyanurate
Dichloroisocyanuric acid sodium salt
Sodium dichlorisocyanurate
3,5-Dichloro-2-hydroxy-4,6-s-triazinedione sodium salt
CDB 63
Simpla
Dikonit
Fi Clor 60S
Clearon
Fi Clor Clearon
CDB Clearon
Neochlor 60P
Oniachlor 60
Hi-Lite 60G
Izosan G
Surchlor GR 60
Hi-Lite 60C
ACL 56
Clearon CDB
Actisan
Clearon CDB 56
Basolan DC
Crente
Hi-Lite G 60GW
SDIC 60P
Prisept
Oxidan DCN/WSG
SDIC-MG
Dichlosia
Fichlor
Presept
Dichloro-s-triazinetrione sodium salt
Vac Attack
Neochlor 60G
Neochlor 55
Neochlor 60MG
Neochlor 60M
Jundujing
Hidrosan
Sumaveg
DICD-G
Neochlor 55G
Javel Solid
Khlorapin
Aviclor
Medicarine
Actisept
Haz-Tab
Haz-Tabs
Histar G
Sodium dicycloroisocyanurate
Identifiers:
SMILES:
O=c1nc(O)n(Cl)c(=O)n1Cl.[Na]
InChI:
InChI=1S/C3HCl2N3O3.Na/c4-7-1(9)6-2(10)8(5)3(7)11;/h(H,6,9,10);
Key Properties
Density
1.00 g/cm³
CAS Common Chemistry
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 | 220.96 g/mol | CAS Common Chemistry |
| 220.955 g/mol | RDKit | |
| 219.929265532 g/mol | RDKit | |
| Density | 1.00 g/cm³ | CAS Common Chemistry |
| 1 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sodium_dichloroisocyanurate | CAS Common Chemistry |
| Canonical SMILES | [Na].O=C1NC(=O)N(Cl)C(=O)N1Cl | CAS Common Chemistry |
| InChI | InChI=1S/C3HCl2N3O3.Na/c4-7-1(9)6-2(10)8(5)3(7)11;/h(H,6,9,10); | CAS Common Chemistry |
| InChI Key | InChIKey=UNWRHVZXVVTASG-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sodium dichloroisocyanurate | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 77.12 Ų | RDKit |
| LogP | -1.2664000000000002 | RDKit |
| Molar Refractivity | 42.6778 | RDKit |
