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Cas Database |
| Name |
[[(1a,3b,5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane] |
EINECS | N/A |
| CAS No. | 111594-58-2 | Density | 0.93 |
| PSA | 18.46000 | LogP | 12.67080 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C40H72 O2 Si2 | Boiling Point | 605.861°C at 760 mmHg |
| Molecular Weight | 641.181 | Flash Point | 273.96°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
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Hazard Symbols | N/A |
| Synonyms |
Silane,[[(1a,3b,5E,7E,22E)-9,10-secoergosta-5,7,10(19),22-tetraene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-(9CI); |
Article Data | 7 |
[[(1a,3b,5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane] Specification
[[(1a,3b,5E,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethylsilane] , has the CAS registry number of 111594-58-2. And it is also known as Silane,[[(1a,3b,5E,7E,22E)-9,10-secoergosta-5,7,10(19),22-tetraene-1,3-diyl]bis(oxy)]bis[(1,1-dimethylethyl)dimethyl-(9CI) .
As the intermediate of doxercalciferol, it is a kind of white acicular crystal. It has been used in compounding various chemicals, such as compound doxercalciferol, Calcipotriol and calcitriol, etc. The storage method is to preserve it by sealing it airtight in the low temperature.
You could convert it into the chemical structure by using the following chainings:
SMILES:
O([Si](C(C)(C)C)(C)C)[C@@H]1CC(\C(=C)[C@@H](O[Si](C(C)(C)C)(C)C)C1)=C/C=C2\CCC[C@]3([C@H]2CC[C@@H]3[C@@H](/C=C/[C@H](C)C(C)C)C)C
InChI:
InChI=1/C40H72O2Si2/c1-28(2)29(3)19-20-30(4)35-23-24-36-32(18-17-25-40(35,36)12)21-22-33-26-34(41-43(13,14)38(6,7)8)27-37(31(33)5)42-44(15,16)39(9,10)11/h19-22,28-30,34-37H,5,17-18,23-27H2,1-4,6-16H3/b20-19+,32-21+,33-22+/t29-,30+,34+,35+,36-,37-,40+/m0/s1
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