3-[(E)-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-4,5,6,7-tetrahydro-2-benzofuran-5-ol
Modify Date: 2024-04-02 09:46:26
![3-[(E)-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-4,5,6,7-tetrahydro-2-benzofuran-5-ol Structure](https://image.chemsrc.com/caspic/197/96999-68-7.png)
3-[(E)-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-4,5,6,7-tetrahydro-2-benzofuran-5-ol structure
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Common Name | 3-[(E)-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-4,5,6,7-tetrahydro-2-benzofuran-5-ol | ||
|---|---|---|---|---|
| CAS Number | 96999-68-7 | Molecular Weight | 414.62100 | |
| Density | 1.085g/cm3 | Boiling Point | 553.3ºC at 760 mmHg | |
| Molecular Formula | C27H42O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 288.4ºC | |
| Name | 3-[(E)-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-4,5,6,7-tetrahydro-2-benzofuran-5-ol |
|---|---|
| Synonym | More Synonyms |
| Density | 1.085g/cm3 |
|---|---|
| Boiling Point | 553.3ºC at 760 mmHg |
| Molecular Formula | C27H42O3 |
| Molecular Weight | 414.62100 |
| Flash Point | 288.4ºC |
| Exact Mass | 414.31300 |
| PSA | 53.60000 |
| LogP | 6.30630 |
| Index of Refraction | 1.562 |
|
~98%
3-[(E)-[1-(6-hy... CAS#:96999-68-7 |
| Literature: Shiina; Miyaura; Tanaka; Abe; Yamada; Yamamoto; Ino; Takayama; Matsunaga; Nishii Journal of Medicinal Chemistry, 1985 , vol. 28, # 9 p. 1153 - 1158 |
|
~5%
3-[(E)-[1-(6-hy... CAS#:96999-68-7 |
| Literature: Shiina; Miyaura; Tanaka; Abe; Yamada; Yamamoto; Ino; Takayama; Matsunaga; Nishii Journal of Medicinal Chemistry, 1985 , vol. 28, # 9 p. 1153 - 1158 |
|
~%
3-[(E)-[1-(6-hy... CAS#:96999-68-7 |
| Literature: Shiina; Miyaura; Tanaka; Abe; Yamada; Yamamoto; Ino; Takayama; Matsunaga; Nishii Journal of Medicinal Chemistry, 1985 , vol. 28, # 9 p. 1153 - 1158 |
![(3S,5R)-3-[(E)-[(1R,3aS,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]methyl]-1,3,4,5,6,7-hexahydro-2-benzofuran-1,5-diol structure](https://image.chemsrc.com/caspic/235/96999-67-6.png)
| Precursor 1 | |
|---|---|
| DownStream 0 | |
| 9,10-Secocholesta-5,7,10(19)-triene-3,25-diol,6,19-epoxy-,(3beta,6R,7E) |
| 25-HE-Vitamin D3 |
| 25-Hydroxy-6,19-epoxyvitamin D3 |