Introduction：Basic information about CAS 79-58-3|Solanid-5-ene-3,12-diol,(3b,12a)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Solanid-5-ene-3,12-diol,(3b,12a)- |
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| CAS Number | 79-58-3 | Molecular Weight | 413.63600 |
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| Density | 1.15g/cm3 | Boiling Point | 537.1ºC at 760 mmHg |
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| Molecular Formula | C27H43NO2 | Melting Point | / |
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| MSDS | / | Flash Point | 251.5ºC |
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Names
| Name | Solanid-5-ene-3,12-diol,(3b,12a) |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.15g/cm3 |
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| Boiling Point | 537.1ºC at 760 mmHg |
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| Molecular Formula | C27H43NO2 |
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| Molecular Weight | 413.63600 |
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| Flash Point | 251.5ºC |
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| Exact Mass | 413.32900 |
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| PSA | 43.70000 |
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| LogP | 4.56370 |
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| Index of Refraction | 1.59 |
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| InChIKey | AANKDJLVHZQCFG-KVHNBARJSA-N |
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| SMILES | CC1CCC2C(C)C3C(CC4C5CC=C6CC(O)CCC6(C)C5CC(O)C43C)N2C1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- WF0300000
- CHEMICAL NAME :
- Solanid-5-ene-3,12-diol, (3-beta,12-alpha)-
- CAS REGISTRY NUMBER :
- 79-58-3
- BEILSTEIN REFERENCE NO. :
- 0095345
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C27-H43-N-O2
- MOLECULAR WEIGHT :
- 413.71
- WISWESSER LINE NOTATION :
- T H6 F5 E5 B666 MN SUTJ A1 E1 GQ G1 K1 VQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 66700 ug/kg
- SEX/DURATION :
- female 7 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetal death
- REFERENCE :
- PSEBAA Proceedings of the Society for Experimental Biology and Medicine. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1903/04- Volume(issue)/page/year: 136,1174,1971
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Synonyms
