Introduction：Basic information about CAS 5301-78-0|Pentaerythritol phosphate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pentaerythritol phosphate |
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| CAS Number | 5301-78-0 | Molecular Weight | 180.096 |
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| Density | 1.5±0.1 g/cm3 | Boiling Point | 270.9±9.0 °C at 760 mmHg |
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| Molecular Formula | C5H9O5P | Melting Point | 209-212ºC |
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| MSDS | / | Flash Point | 117.6±18.7 °C |
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Names
| Name | (1-oxo-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octan-4-yl)methanol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.5±0.1 g/cm3 |
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| Boiling Point | 270.9±9.0 °C at 760 mmHg |
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| Melting Point | 209-212ºC |
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| Molecular Formula | C5H9O5P |
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| Molecular Weight | 180.096 |
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| Flash Point | 117.6±18.7 °C |
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| Exact Mass | 180.018753 |
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| PSA | 74.80000 |
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| LogP | -1.08 |
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| Vapour Pressure | 0.0±1.2 mmHg at 25°C |
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| Index of Refraction | 1.503 |
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| InChIKey | YASRHLDAFCMIPB-UHFFFAOYSA-N |
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| SMILES | O=P12OCC(CO)(CO1)CO2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- YK0690700
- CHEMICAL NAME :
- 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane-4-methanol , 1-oxide
- CAS REGISTRY NUMBER :
- 5301-78-0
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C5-H9-O5-P
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- SCIEAS Science. (American Assoc. for the Advancement of Science, 1333 H St., NW, Washington, DC 20005) V.1- 1895- Volume(issue)/page/year: 182,1135,1973
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2909499000 |
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Customs
| HS Code | 2909499000 |
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| Summary | 2909499000. ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0% |
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Synonyms
| O,O',O''-phosphoryl-pentaerythritol |
| pentaerythritol phosphate alcohol |
| 2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane-4-methanol, 1-oxide |
| 2,4-HEPTADECADIYNOIC ACID |
| (1-Oxido-2,6,7-trioxa-1-phosphabicyclo[2.2.2]oct-4-yl)methanol |
| CN 1137 |
| 2,6,7-Trioxa-1-phospha bicyclo 2.2.2 octane-4-methanol, 1-oxide |
