Cas no 38636-79-2 (Cholane-24-carboxylic acid, 3-hydroxy-, methyl ester, (3α,5β)-)

Cholane-24-carboxylic acid, 3-hydroxy-, methyl ester, (3α,5β)- structure
38636-79-2 structure
Product Name:Cholane-24-carboxylic acid, 3-hydroxy-, methyl ester, (3α,5β)-
CAS No:38636-79-2
MF:C26H44O3
MW:404.625768661499
CID:6625160
Update Time:2024-01-08

Cholane-24-carboxylic acid, 3-hydroxy-, methyl ester, (3α,5β)- Chemical and Physical Properties

Names and Identifiers

    • Cholane-24-carboxylic acid, 3-hydroxy-, methyl ester, (3α,5β)-
    • Inchi: 1S/C26H44O3/c1-17(6-5-7-24(28)29-4)21-10-11-22-20-9-8-18-16-19(27)12-14-25(18,2)23(20)13-15-26(21,22)3/h17-23,27H,5-16H2,1-4H3/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1
    • InChI Key: LTQDWHSSBYCHIF-GBURMNQMSA-N
    • SMILES: [C@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H]([C@H](C)CCCC(OC)=O)CC3)CC2

Experimental Properties

  • Density: 1.030±0.06 g/cm3(Predicted)
  • Boiling Point: 486.8±18.0 °C(Predicted)
  • pka: 15.14±0.70(Predicted)
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