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Name |
2-(4,6-Dichloro-s-triazin-2-ylamino)-4-(4-amino-3-sulfo-1-anthraquinonyl-amino)benzenesulfonic acid, disodium salt |
EINECS | 224-797-1 |
CAS No. | 4499-01-8 | Density | N/A |
PSA | 254.05000 | LogP | 5.72020 |
Solubility | N/A | Melting Point |
N/A |
Formula | C23H14 Cl2 N6 O8 S2 . 2 Na | Boiling Point | N/A |
Molecular Weight | 681.41 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Mildly toxic by ingestion. A severe eye irritant. When heated to decomposition it emits very toxic fumes of Cl−, NOx, Na2O, and SOx. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Anthracenesulfonicacid,1-amino-4-[3-[(4,6-dichloro-s-triazin-2-yl)amino]-4-sulfoanilino]-9,10-dihydro-9,10-dioxo-,disodium salt (7CI,8CI);2-Anthracenesulfonic acid,1-amino-4-[[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-,disodium salt (9CI);Azure KX;Procion Brilliant Blue M-RS;Reactive BrilliantBlue KKh;Reactive Brilliant Sky Blue KKh; |
Molecular Structure of 2-(4,6-Dichloro-s-triazin-2-ylamino)-4-(4-amino-3-sulfo-1-anthraquinonyl-amino)benzenesulfonic acid, disodium salt (CAS NO.4499-01-8):
IUPAC Name: disodium 1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfonatoanilino]-9,10-dioxoanthracene-
2-sulfonate
Empirical Formula: C23H12Cl2N6Na2O8S2
Molecular Weight: 681.3923
Synonyms of 2-(4,6-Dichloro-s-triazin-2-ylamino)-4-(4-amino-3-sulfo-1-anthraquinonyl-amino)benzenesulfonic acid, disodium salt (CAS NO.4499-01-8):
disodium 1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulphonatoanilino]-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate ; 2-Anthracenesulfonic acid, 1-amino-4-3-(4,6-dichloro-1,3,5-triazin-2-yl)amino-4-sulfophenylamino-9,10-dihydro-9,10-dioxo-, disodium salt ; 2-(4,6-dichloro-s-triazin-2-ylamino)-4-(4-amino-3-sulfo-1 10-dihydro-9,10-dioxo-o]-4-sulfophenyl]amino]- disodium salt ; blue kkh ; brilliant blue kkh ; reactive sky ; 1-Amino-4-[[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid disodium salt ; 1-Amino-4-[3-(4,6-dichloro-1,3,5-triazin-2-ylamino)-4-sulfoanilino]-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid disodium salt
H bond acceptors: 14
H bond donors: 6
Freely Rotating Bonds: 6
Polar Surface Area: 208.03A2
1. | eye-rbt 100 mg/24H SEV | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,242. | ||
2. | orl-rat LD50:8980 mg/kg | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,242. |
Reported in EPA TSCA Inventory.
Mildly toxic by ingestion. A severe eye irritant. When heated to decomposition it emits very toxic fumes of Cl−, NOx, Na2O, and SOx.