Introduction:Basic information about CAS 14969-56-3|Xanthylium,3,6-bis(diethylamino)-9-[2-[[[9-(diethylamino)-5H-benzo[a]phenoxazin-5-yli, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Xanthylium,3,6-bis(diethylamino)-9-[2-[[[9-(diethylamino)-5H-benzo[a]phenoxazin-5-ylidene]amino]carbonyl]phenyl]-,chloride (1:1) |
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| CAS Number | 14969-56-3 | Molecular Weight | 780.39500 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C48H50ClN5O3 | Melting Point | / |
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| MSDS | USA | Flash Point | / |
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Names
| Name | rhodanile blue |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C48H50ClN5O3 |
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| Molecular Weight | 780.39500 |
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| Exact Mass | 779.36000 |
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| PSA | 73.32000 |
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| LogP | 7.05730 |
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| Vapour Pressure | 1.58E-31mmHg at 25°C |
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| Index of Refraction | 1.639 |
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| InChIKey | UYQVPCFMVWEDCA-UHFFFAOYSA-M |
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| SMILES | CCN(CC)c1ccc2nc3c4ccccc4c(=NC(=O)c4ccccc4-c4c5ccc(N(CC)CC)cc5[o+]c5cc(N(CC)CC)ccc45)cc-3oc2c1.[Cl-] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- BP6700000
- CHEMICAL NAME :
- Ammonium, (6-(diethylamino)-9-(o-((9-(diethylamino)-5H-benzo(a) phenoxazin-5-ylidene) carbamoyl)phenyl)-3H-xanthen-3-ylidene)diethyl-, chloride
- CAS REGISTRY NUMBER :
- 14969-56-3
- LAST UPDATED :
- 199504
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C48-H48-N5-O3.Cl
- MOLECULAR WEIGHT :
- 778.46
- WISWESSER LINE NOTATION :
- &G
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 33 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 44,225,1978 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1534 No. of Facilities: 10 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 40 (estimated) No. of Female Employees: 40 (estimated)
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Safety Information
| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | 20/21/22-40 |
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| Safety Phrases | 26-36/37/39-36-22 |
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| RIDADR | UN 3143 |
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| RTECS | BP6700000 |
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Synonyms
| 3,6-bis(diethylamino)-9-[2-[[[9-(diethylamino)-5H-benzo[a]phenoxazin-5-ylidene]amino]carbonyl]phenyl]xanthylium chloride |
| MFCD00011937 |
| RHODANILEBLUE2 |
| ammonium,(6-(diethylamino)-9-(o-((9-(diethylamino)-5h-benzo(a)phenoxazin-5-yli |
| EINECS 239-040-0 |