Cas no 633-31-8 ([(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate)

[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate structure
633-31-8 structure
Product Name:[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate
CAS No:633-31-8
MF:C30H50O2
MW:442.716809749603
MDL:MFCD00021143
CID:39309
PubChem ID:87565764
Update Time:2025-04-18

[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate Chemical and Physical Properties

Names and Identifiers

    • Cholesteryl propionate
    • Cholest-5-en-3beta-yl propionate
    • Cholesterol Propionate
    • Propionic Acid Cholesterol Ester
    • Cholest-5-en-3-ol (3
    • A)-, 3-propanoate
    • [(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahyd
    • D95344
    • CCORPVHYPHHRKB-NXUCFJMCSA-N
    • AKOS015839618
    • 633-31-8
    • HY-W013128
    • Cholesterol, propionate
    • Propionyloxy-3.beta. cholestene-5
    • CS-W013844
    • AS-63211
    • Cholesterol n-propionate
    • L-Phe-7-Amino-4-Methylcoumarin
    • (3I(2))-cholest-5-en-3-yl propanoate
    • MFCD00021143
    • (3beta)-Cholest-5-en-3-yl propionate
    • Cholesterinpropionat
    • NS00041600
    • (3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl propionate
    • cholesteryl propanoate
    • Cholest-5-en-3-ol (3beta)-, 3-propanoate
    • NSC 226871
    • W-104917
    • SCHEMBL161165
    • [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate
    • Cholest-5-en-3-yl propionate #
    • 3.beta.-Propanoyloxycholest-5-ene
    • (1R,3AS,3BS,7S,9AR,9BS,11AR)-9A,11A-DIMETHYL-1-[(2R)-6-METHYLHEPTAN-2-YL]-1H,2H,3H,3AH,3BH,4H,6H,7H,8H,9H,9BH,10H,11H-CYCLOPENTA[A]PHENANTHREN-7-YL PROPANOATE
    • FC61973
    • Cholest-5-en-3-ol (3.beta.)-, 3-propanoate
    • [(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate
    • MDL: MFCD00021143
    • Inchi: 1S/C30H50O2/c1-7-28(31)32-23-15-17-29(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)30(26,6)18-16-27(24)29/h11,20-21,23-27H,7-10,12-19H2,1-6H3/t21-,23+,24+,25-,26+,27+,29+,30-/m1/s1
    • InChI Key: CCORPVHYPHHRKB-NXUCFJMCSA-N
    • SMILES: O(C(CC)=O)[C@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@H]21

Computed Properties

  • Exact Mass: 442.38100
  • Monoisotopic Mass: 442.381
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 8
  • Complexity: 708
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26.3
  • XLogP3: 9.6

Experimental Properties

  • Color/Form: White powder
  • Density: 0.9882 (rough estimate)
  • Melting Point: 97-100 oC
  • Boiling Point: 493.26°C (rough estimate)
  • Flash Point: 256.6°C
  • Refractive Index: -40 ° (C=2, CHCl3)
  • PSA: 26.30000
  • LogP: 8.34960
  • Solubility: Insoluble in water.
  • Vapor Pressure: 0.0±1.3 mmHg at 25°C

[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate Security Information

[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate Pricemore >>

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[(8S,9R,10R,13R,14S)-10,13-Dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate Related Literature

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