Cas no 132014-43-8 (1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)-)

1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)- structure
132014-43-8 structure
Product Name:1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)-
CAS No:132014-43-8
MF:C28H46O4
MW:446.662449359894
CID:199454
PubChem ID:9547494
Update Time:2025-04-19

1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)-
    • (1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-1-[(1R)-1-(5-hydroxy-5-methylhexoxy)ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
    • 1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H
    • LMST03020382
    • (5Z,7E)-(1S,3R,20R)-24a,24b-Dihomo-22-oxa-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol
    • AKOS040752259
    • 1,3-Cyclohexanediol, 4-methylene-5-((octahydro-1-(1-((5-hydroxy-5-methylhexyl)oxy)ethyl)-7a-methyl-4H-inden-4-ylidene)ethylidene)-, (1S-(1alpha(S*),3abeta,4E(1S*,3R*,5Z),7aalpha))-
    • (1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1R)-1-(5-hydroxy-5-methylhexoxy)ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
    • (1S-(1alpha(S*),3abeta,4E(1S*,3R*,5Z),7aalpha))-4-Methylene-5-((octahydro-1-(1-((5-hydroxy-5-methylhexyl)oxy)ethyl)-7a-methyl-4H-inden-4-ylidene)ethylidene)-1,3-cyclohexanediol
    • CHEBI:178543
    • (5Z,7E)-(1S,3R,20R)-24a,24b-dihomo-22-oxa-9,10-seco-5,7,10(19) -cholestatrien-1,3,25-triol
    • KH-1049
    • 132014-43-8
    • 1alpha,25-dihydroxy-24a,24b-dihomo-22-oxa-20-epivitamin D3 / 1alpha,25-dihydroxy-24a,24b-dihomo-22-oxa-20-epicholecalciferol
    • Inchi： 1S/C28H46O4/c1-19-22(17-23(29)18-26(19)30)11-10-21-9-8-15-28(5)24(12-13-25(21)28)20(2)32-16-7-6-14-27(3,4)31/h10-11,20,23-26,29-31H,1,6-9,12-18H2,2-5H3/b21-10+,22-11-/t20-,23-,24-,25+,26+,28-/m1/s1
    • InChI Key： MEJNJVYTSDEKIO-RZSWPJQSSA-N
    • SMILES： O(CCCCC(C)(C)O)[C@H](C)[C@H]1CC[C@H]2/C(=C/C=C3\C(=C)[C@H](C[C@@H](C\3)O)O)/CCC[C@@]21C

Computed Properties

  • Exact Mass: 446.33961
  • Monoisotopic Mass: 446.33961
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 8
  • Complexity: 721
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 2
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 69.9
  • XLogP3: 4.2

Experimental Properties

  • Density: 1.07
  • Boiling Point: 590°Cat760mmHg
  • Flash Point: 310.6°C
  • Refractive Index: 1.544

1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)- Related Literature

132014-43-8 (1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1S,3aS,7aS)-octahydro-1-[(1R)-1-[(5-hydroxy-5-methylhexyl)oxy]ethyl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)-) Related Products

Recommended suppliers
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk