Introduction:Basic information about CAS 125-58-6|(6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one |
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| CAS Number | 125-58-6 | Molecular Weight | 309.44500 |
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| Density | 1.009g/cm3 | Boiling Point | 423.7ºC at 760mmHg |
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| Molecular Formula | C21H27NO | Melting Point | 99-100ºC |
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| MSDS | / | Flash Point | 126.5ºC |
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Names
| Name | (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.009g/cm3 |
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| Boiling Point | 423.7ºC at 760mmHg |
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| Melting Point | 99-100ºC |
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| Molecular Formula | C21H27NO |
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| Molecular Weight | 309.44500 |
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| Flash Point | 126.5ºC |
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| Exact Mass | 309.20900 |
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| PSA | 20.31000 |
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| LogP | 4.29200 |
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| Vapour Pressure | 2.2E-07mmHg at 25°C |
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| Index of Refraction | 1.538 |
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| InChIKey | USSIQXCVUWKGNF-QGZVFWFLSA-N |
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| SMILES | CCC(=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- MJ5990000
- CHEMICAL NAME :
- 3-Heptanone, 6-(dimethylamino)-4,4-diphenyl-, L-
- CAS REGISTRY NUMBER :
- 125-58-6
- BEILSTEIN REFERENCE NO. :
- 3213668
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 6
- MOLECULAR FORMULA :
- C21-H27-N-O
- MOLECULAR WEIGHT :
- 309.49
- WISWESSER LINE NOTATION :
- 2VXR&R&1Y1&N1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 97 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 32 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 26500 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 1600 ug/kg
- SEX/DURATION :
- male 1 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Paternal Effects - other effects on male
MUTATION DATA - TYPE OF TEST :
- Mutation test systems - not otherwise specified
- TEST SYSTEM :
- Rodent - rat Testis
- DOSE/DURATION :
- 50 umol/L
- REFERENCE :
- BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 27,123,1978
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Safety Information
Customs
| HS Code | 2922399090 |
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| Summary | 2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| Levothyl |
| Levadone |
| l-Polamivet |
| Polamivet |
| l-methadone |
| L-Polamidon |
| Levomethadone |