Introduction：Basic information about CAS 1059-86-5|Cholesta-5,7-dien-3-ol,3-acetate, (3b)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Cholesta-5,7-dien-3-ol,3-acetate, (3b)- |
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| CAS Number | 1059-86-5 | Molecular Weight | 426.67400 |
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| Density | 1.01g/cm3 | Boiling Point | 505.2ºC at 760 mmHg |
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| Molecular Formula | C29H46O2 | Melting Point | / |
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| MSDS | / | Flash Point | 256.3ºC |
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Names
| Name | [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.01g/cm3 |
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| Boiling Point | 505.2ºC at 760 mmHg |
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| Molecular Formula | C29H46O2 |
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| Molecular Weight | 426.67400 |
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| Flash Point | 256.3ºC |
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| Exact Mass | 426.35000 |
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| PSA | 26.30000 |
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| LogP | 7.87960 |
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| Vapour Pressure | 2.48E-10mmHg at 25°C |
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| Index of Refraction | 1.524 |
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| InChIKey | ACGNVBRAISEVDK-RPIQFHTISA-N |
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| SMILES | CC(=O)OC1CCC2(C)C(=CC=C3C2CCC2(C)C3CCC2C(C)CCCC(C)C)C1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- FZ5680000
- CHEMICAL NAME :
- Cholesta-5,7-dien-3-ol, acetate, (3-beta)
- CAS REGISTRY NUMBER :
- 1059-86-5
- BEILSTEIN REFERENCE NO. :
- 3224391
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C29-H46-O2
- MOLECULAR WEIGHT :
- 426.75
- WISWESSER LINE NOTATION :
- L E5 B666 JU LUTJ A1 E1 FY1&3Y1&1 OOV1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 200 mg/kg/90D-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application
- REFERENCE :
- NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 209,1026,1966
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Synonyms
| 7-dehydrocholesterol-3-acetate |
| 3-O-acetyl-7-dehydrocholesterol |
| Cholesta-5,acetate |
| 7-dehydrochloresterol acetate |
| 7,8-Didehydrocholesteryl-acetat |
