(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

Modify Date: 2024-01-02 21:31:56

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure
(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol structure
Common Name (1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
CAS Number 111687-67-3 Molecular Weight 402.61000
Density 1.04g/cm3 Boiling Point 530.1ºC at 760mmHg
Molecular Formula C26H42O3 Melting Point N/A
MSDS N/A Flash Point 274.4ºC

 Names

Name (1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.04g/cm3
Boiling Point 530.1ºC at 760mmHg
Molecular Formula C26H42O3
Molecular Weight 402.61000
Flash Point 274.4ºC
Exact Mass 402.31300
PSA 49.69000
LogP 5.57860
Vapour Pressure 1.88E-13mmHg at 25°C
Index of Refraction 1.535

 Synthetic Route

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

~%

(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-7a-methyl-1-[(1S)-1-(3-methylbutoxy)ethyl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol Structure

(1R,3S,5E)-5-[(...

CAS#:111687-67-3

Literature: Murayama; Miyamoto; Kubodera; Mori; Matsunaga Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 10 p. 4410 - 4413

 Synonyms

1,3-Cyclohexanediol,4-methylene-5-(2-(octahydro-7a-methyl-1-(1-(3-methylbutoxy)ethyl)-4H-inden-4-ylidene)ethylidene)-,(1S-(1alpha(R*),3abeta,4E(1S*,3R*,5Z),7aalpha))
1-Hydroxy-22-oxavitamin D3
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