Introduction:Basic information about CAS 522-40-7|fosfestrol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | fosfestrol |
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| CAS Number | 522-40-7 | Molecular Weight | 428.31000 |
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| Density | 1.433g/cm3 | Boiling Point | 648.7ºC at 760mmHg |
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| Molecular Formula | C18H22O8P2 | Melting Point | / |
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| MSDS | / | Flash Point | 346.1ºC |
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Names
| Name | [4-[(E)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.433g/cm3 |
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| Boiling Point | 648.7ºC at 760mmHg |
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| Molecular Formula | C18H22O8P2 |
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| Molecular Weight | 428.31000 |
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| Flash Point | 346.1ºC |
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| Exact Mass | 428.07900 |
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| PSA | 153.14000 |
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| LogP | 4.36040 |
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| Index of Refraction | 1.609 |
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| InChIKey | NLORYLAYLIXTID-ISLYRVAYSA-N |
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| SMILES | CCC(=C(CC)c1ccc(OP(=O)(O)O)cc1)c1ccc(OP(=O)(O)O)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- WJ5680000
- CHEMICAL NAME :
- 4,4'-Stilbenediol, alpha,alpha'-diethyl-, bis(dihydrogen phosphate), (E)-
- CAS REGISTRY NUMBER :
- 522-40-7
- LAST UPDATED :
- 199504
- DATA ITEMS CITED :
- 12
- MOLECULAR FORMULA :
- C18-H22-O8-P2
- MOLECULAR WEIGHT :
- 428.34
- WISWESSER LINE NOTATION :
- QPQO&OR DY2&UY2&R DOPQQO
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Human - man
- DOSE/DURATION :
- 11 mg/kg/3D-I
- TOXIC EFFECTS :
- Vascular - BP lowering not characterized in autonomic section Blood - change in clotting factors Skin and Appendages - sweating
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 3 gm/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 :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 425 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 :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2 gm/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 :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 630 mg/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 :
- Intraperitoneal
- DOSE :
- 400 mg/kg
- SEX/DURATION :
- female 6 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - cytological changes (including somatic cell genetic material)
- TYPE OF TEST :
- Cytogenetic analysis
- TYPE OF TEST :
- Sex chromosome loss and nondisjunction
MUTATION DATA - TYPE OF TEST :
- Mutation test systems - not otherwise specified
- TEST SYSTEM :
- Mammal - species unspecified Lymphocyte
- DOSE/DURATION :
- 25 nmol/L
- REFERENCE :
- CYTOAN Cytologia. (Japan Pub. Trading Co. (USA), 1255 Howard St., San Francisco, CA 94103) V.1- 1929- Volume(issue)/page/year: 40,817,1975 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X3653 No. of Facilities: 86 (estimated) No. of Industries: 1 No. of Occupations: 6 No. of Employees: 9667 (estimated) No. of Female Employees: 7994 (estimated)
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Synonyms
| ST52-Asta |
| Stilbestrol diphosphate |
| Fosfestrolum [INN-Latin] |
| Phosphestrol |
| Diethylstilbestryl diphosphate |
| fosfestrol |
| 3,4-Bis-(4-phosphonooxy-phenyl)-hex-3t-en |
| Diethylstilbestrol diphosphate |
| Phosphoestrolum |
| Honvan |
| Desdp |
| 3,4-bis-(4-phosphonooxy-phenyl)-hex-3t-ene |