Introduction：Basic information about CAS 7101-51-1|Melevodopa, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Melevodopa |
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| CAS Number | 7101-51-1 | Molecular Weight | 211.21500 |
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| Density | 1.322g/cm3 | Boiling Point | 384.4ºC at 760 mmHg |
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| Molecular Formula | C10H13NO4 | Melting Point | / |
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| MSDS | / | Flash Point | 186.3ºC |
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Names
| Name | methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.322g/cm3 |
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| Boiling Point | 384.4ºC at 760 mmHg |
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| Molecular Formula | C10H13NO4 |
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| Molecular Weight | 211.21500 |
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| Flash Point | 186.3ºC |
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| Exact Mass | 211.08400 |
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| PSA | 92.78000 |
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| LogP | 0.84090 |
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| Index of Refraction | 1.592 |
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| InChIKey | XBBDACCLCFWBSI-ZETCQYMHSA-N |
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| SMILES | COC(=O)C(N)Cc1ccc(O)c(O)c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AY5960000
- CHEMICAL NAME :
- Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, L-
- CAS REGISTRY NUMBER :
- 7101-51-1
- BEILSTEIN REFERENCE NO. :
- 3056415
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C10-H13-N-O4
- MOLECULAR WEIGHT :
- 211.24
- WISWESSER LINE NOTATION :
- QR BQ D1YZVO1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
MUTATION DATA - TYPE OF TEST :
- DNA inhibition
- TEST SYSTEM :
- Rodent - mouse Cells - not otherwise specified
- DOSE/DURATION :
- 3300 nmol/L
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 40,1414,1980
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Safety Information
| Hazard Codes | Xn |
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| HS Code | 2922509090 |
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Customs
| HS Code | 2922509090 |
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| Summary | 2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 3-Hydroxy-L-tyrosine methyl ester |
| (S)-(-)-methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate |
| (S)-2-Amino-3-(3,4-dihydroxy-phenyl |
| 3,4-dihydroxy-L-phenylalanine methyl ester |
| L-Dopa methyl ester |
| Levodopa methyl ester |
| Melevodopa (INN) |
| methyl-L-DOPA |
| Melevodopa |
| (2S)-2-amino-3-(3,4-dihydroxy-phenyl)-propionic acid methyl ester |
