Introduction：Basic information about CAS 3916-18-5|(2R,5R)-2,5-HEXANEDIOL, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (2R,5R)-2,5-HEXANEDIOL |
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| CAS Number | 3916-18-5 | Molecular Weight | 213.18700 |
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| Density | 1.608g/cm3 | Boiling Point | 549.8ºC at 760mmHg |
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| Molecular Formula | C9H11NO5 | Melting Point | >200ºC |
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| MSDS | / | Flash Point | 286.3ºC |
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Names
| Name | DL-threo-Droxidopa |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.608g/cm3 |
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| Boiling Point | 549.8ºC at 760mmHg |
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| Melting Point | >200ºC |
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| Molecular Formula | C9H11NO5 |
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| Molecular Weight | 213.18700 |
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| Flash Point | 286.3ºC |
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| Exact Mass | 213.06400 |
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| PSA | 124.01000 |
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| LogP | 0.24340 |
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| Appearance of Characters | powder | off-white to yellow-tan |
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| Index of Refraction | 1.692 |
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| Storage condition | -15°C |
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| Water Solubility | ethanol: 50 mg/mL Solutions should be freshly prepared. |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VT9626000
- CHEMICAL NAME :
- Serine, 3-(3,4-dihydroxyphenyl)-, DL-threo-
- CAS REGISTRY NUMBER :
- 3916-18-5
- BEILSTEIN REFERENCE NO. :
- 2852792
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C9-H11-N-O5
- MOLECULAR WEIGHT :
- 213.21
- WISWESSER LINE NOTATION :
- QVYZYQR CQ DQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #81-104815
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #81-104815
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Safety Information
| Safety Phrases | S24/25 |
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| WGK Germany | 2 |
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| RTECS | VT9626000 |
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Synonyms
| (2rs,3rs)-2-amino-3-(3,4-dihydroxy-phenyl)-3-hydroxy-propionic acid |
