Cas no 30004-10-5 (1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)-)

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)- structure
30004-10-5 structure
Product Name:1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)-
CAS No:30004-10-5
MF:C40H58MgO4
MW:627.191133022308
CID:312870
PubChem ID:21120085
Update Time:2025-04-19

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)- Chemical and Physical Properties

Names and Identifiers

    • 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)-
    • 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4
    • magnesium,1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
    • Magnesium abietate, technical
    • magnesium diabieta-7,13-dien-18-oate
    • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, magnesium salt (2:1), (1R,4aR,4bR,10aR)-
    • NS00084034
    • DTXSID20952416
    • magnesium abietate
    • SCHEMBL3930053
    • 30004-10-5
    • VND7CN6K8Z
    • Inchi： 1S/2C20H30O2.Mg/c2*1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h2*7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);/q;;+2/p-2/t2*16-,17+,19+,20+;/m00./s1
    • InChI Key： RVVVYWVQSZTDIK-JHZYRPMRSA-L
    • SMILES： [Mg+2].[O-]C([C@]1(C)CCC[C@]2(C)[C@H]3CCC(C(C)C)=CC3=CC[C@H]21)=O.[O-]C([C@]1(C)CCC[C@]2(C)[C@H]3CCC(C(C)C)=CC3=CC[C@H]21)=O

Computed Properties

  • Exact Mass: 626.419
  • Monoisotopic Mass: 626.419
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 45
  • Rotatable Bond Count: 2
  • Complexity: 536
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 8
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 80.3?2

Experimental Properties

  • Boiling Point: 439.5°Cat760mmHg
  • Flash Point: 208.1°C

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)- Related Literature

30004-10-5 (1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-,magnesium salt (2:1), (1R,4aR,4bR,10aR)-) Related Products

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