Cas no 34434-99-6 (2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI))

2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) structure
34434-99-6 structure
Product Name:2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI)
CAS No:34434-99-6
MF:C34H54O4
MW:526.790171146393
MDL:MFCD04972124
CID:294832
PubChem ID:14447054
Update Time:2025-04-19

2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • α-Onocerin diacetate
    • α-Onocerin diacetateneat
    • 21-HYDROXYPREGNENOLONE 3,21-DIACETATE
    • AKOS040761340
    • ALPHA-ONOCERIN DIACETATE
    • [(2S,4aR,5S,8aR)-5-[2-[(1S,4aR,6S,8aR)-6-acetyloxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-1,1,4a-trimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] acetate
    • FS-8791
    • ALPHA-ONOCERINDIACETATE
    • 34434-99-6
    • (2S,2'S,4aR,4a'R,5S,5'S,8aR,8a'R)-5,5'-(ethane-1,2-diyl)bis(1,1,4a-trimethyl-6-methylenedecahydronaphthalene-5,2-diyl) diacetate
    • 1,2-Ethanediylbis[(1s,4ar,6s,8ar)-5,5,8a-trimethyl-2-methylenedecahydronaphthalene-1,6-diyl] diacetate
    • DB-250033
    • (2S,4aR,5S,8aR)-5-{2-[(1S,4aR,6S,8aR)-6-(acetyloxy)-5,5,8a-trimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl]ethyl}-1,1,4a-trimethyl-6-methylidene-hexahydro-2H-naphthalen-2-yl acetate
    • 2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI)
    • MDL: MFCD04972124
    • Inchi: 1S/C34H54O4/c1-21-11-15-27-31(5,6)29(37-23(3)35)17-19-33(27,9)25(21)13-14-26-22(2)12-16-28-32(7,8)30(38-24(4)36)18-20-34(26,28)10/h25-30H,1-2,11-20H2,3-10H3/t25-,26-,27-,28-,29-,30-,33+,34+/m0/s1
    • InChI Key: JLJPBXMYIMNQDP-JKCFVQEBSA-N
    • SMILES: O(C(C)=O)[C@H]1CC[C@]2(C)[C@H](C(=C)CC[C@H]2C1(C)C)CC[C@H]1C(=C)CC[C@H]2C(C)(C)[C@H](CC[C@@]21C)OC(C)=O

Computed Properties

  • Exact Mass: 526.40200
  • Monoisotopic Mass: 526.40221020g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 7
  • Complexity: 897
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 8.6
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 550.5±50.0 °C at 760 mmHg
  • Flash Point: 258.7±28.5 °C
  • PSA: 52.60000
  • LogP: 8.44740
  • Vapor Pressure: 0.0±1.5 mmHg at 25°C

2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) Security Information

2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) Pricemore >>

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2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) Production Method

2-Naphthalenol,5,5'-(1,2-ethanediyl)bis[decahydro-1,1,4a-trimethyl-6-methylene-, diacetate,(2S,2'S,4aR,4'aR,5S,5'S,8aR,8'aR)- (9CI) Related Literature

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