Introduction:Basic information about CAS 1035-77-4|Estra-1,3,5(10)-trien-17-ol,3-methoxy-, (17b)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Estra-1,3,5(10)-trien-17-ol,3-methoxy-, (17b)- |
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| CAS Number | 1035-77-4 | Molecular Weight | 286.40900 |
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| Density | 1.109 g/cm3 | Boiling Point | 428.8ºC at 760 mmHg |
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| Molecular Formula | C19H26O2 | Melting Point | / |
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| MSDS | / | Flash Point | 187.9ºC |
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Names
| Name | (8R,9S,13S,14S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.109 g/cm3 |
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| Boiling Point | 428.8ºC at 760 mmHg |
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| Molecular Formula | C19H26O2 |
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| Molecular Weight | 286.40900 |
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| Flash Point | 187.9ºC |
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| Exact Mass | 286.19300 |
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| PSA | 29.46000 |
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| LogP | 3.91220 |
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| Vapour Pressure | 4.07E-08mmHg at 25°C |
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| Index of Refraction | 1.566 |
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| InChIKey | ULAADVBNYHGIBP-GFEQUFNTSA-N |
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| SMILES | COc1ccc2c(c1)CCC1C2CCC2(C)C(O)CCC12 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- KG7732000
- CHEMICAL NAME :
- Estra-1,3,5(10)-trien-17-beta-ol, 3-methoxy-
- CAS REGISTRY NUMBER :
- 1035-77-4
- LAST UPDATED :
- 198910
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C19-H26-O2
- MOLECULAR WEIGHT :
- 286.45
- WISWESSER LINE NOTATION :
- L E5 B666TTT&J E1 FQ OO1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 2 mg/kg
- SEX/DURATION :
- male 1 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands
- REFERENCE :
- ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 49,193,1965
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 2500 ug/kg
- SEX/DURATION :
- female 1 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Maternal Effects - ovaries, fallopian tubes Reproductive - Fertility - other measures of fertility
- REFERENCE :
- ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 49,193,1965
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 132 ug/kg
- SEX/DURATION :
- female 3 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Fertility - other measures of fertility
- REFERENCE :
- ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 47,444,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 1050 ug/kg
- SEX/DURATION :
- female 3-9 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
- REFERENCE :
- ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 47,444,1964
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Subcutaneous
- DOSE :
- 3 mg/kg
- SEX/DURATION :
- female 1 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Fertility - other measures of fertility
- REFERENCE :
- 85GRAA "The Control of Fertility," Pincus, G., New York, Academic Press, 1965 Volume(issue)/page/year: -,57,1965
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Synonyms
| 3-methoxyestra-1,3,5(10)-trien-17-|A-ol |
| EINECS 213-858-8 |
| 17beta-Estradiol 3-methyl ether |
| [3H]-3-Methoxyestradiol |
| Oestradiol 3-methyl ether |
| [14C]-3-Methoxyestradiol |
| 3-Methoxyoestradiol |
| 3-O-Methyl Estradiol |
| Estradiol 3-methyl ether |
| 3-Methoxyestradiol |
| Estradiol-17beta-3-methyl ether |