Introduction:Basic information about CAS 4499-01-8|disodium 1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulphonatoanil, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 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 |
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| CAS Number | 4499-01-8 | Molecular Weight | 681.39200 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C23H12Cl2N6Na2O8S2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | disodium,1-amino-4-[3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-sulfonatoanilino]-9,10-dioxoanthracene-2-sulfonate |
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Chemical & Physical Properties
| Molecular Formula | C23H12Cl2N6Na2O8S2 |
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| Molecular Weight | 681.39200 |
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| Exact Mass | 679.93300 |
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| PSA | 254.05000 |
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| LogP | 5.72020 |
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| InChIKey | DHHMYWVFMSHEIP-UHFFFAOYSA-L |
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| SMILES | Nc1c(S(=O)(=O)[O-])cc(Nc2ccc(S(=O)(=O)[O-])c(Nc3nc(Cl)nc(Cl)n3)c2)c2c1C(=O)c1ccccc1C2=O.[Na+].[Na+] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DB6045000
- CHEMICAL NAME :
- Benzenesulfonic acid, 2-(4,6-dichloro-s-triazin-2-ylamino)-4-(4-amino-3-sul fo-1- anthraquinonylamino)-, disodium salt
- CAS REGISTRY NUMBER :
- 4499-01-8
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C23-H12-Cl2-N6-O8-S2.2Na
- MOLECULAR WEIGHT :
- 681.41
- WISWESSER LINE NOTATION :
- L C666 BV IVJ DZ ESWO GMR DSWO CM- BT6N CN ENJ DG FG &-NA- 2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku," Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,242,1972 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 8980 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 28ZPAK "Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku," Marhold, J.V., Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha, Czechoslovakia, 1972 Volume(issue)/page/year: -,242,1972
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