Cas no 28161-39-9 (1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)-)

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)- structure
28161-39-9 structure
Product Name:1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)-
CAS No:28161-39-9
MF:C20H27NaO2
MW:322.416957139969
CID:252535
PubChem ID:23668614
Update Time:2025-04-19

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)- Chemical and Physical Properties

Names and Identifiers

    • 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)-
    • 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)
    • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodium salt, (1R,4aS,10aR)-
    • Sodium (1R-(1alpha,4abeta,10aalpha))-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate
    • sodium abieta-8,11,13-trien-18-oate
    • ABIETA DR 835A
    • sodium;(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
    • MCO4K53W9N
    • PODOCARPA-8,11,13-TRIEN-15-OIC ACID, 13-ISOPROPYL-, SODIUM SALT
    • 1-PHENANTHRENECARBOXYLIC ACID, 1,2,3,4,4A,9,10,10A-OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-, SODIUM SALT, (1R-(1.ALPHA.,4A.BETA.,10A.ALPHA.))-
    • 28161-39-9
    • sodium;(1R, 4aS, 10aR)-1, 4a-dimethyl-7-propan-2-yl-2, 3, 4, 9, 10, 10a-hexahydrophenanthrene-1-carboxylate
    • Dehydroabietic acid sodium salt
    • Sodium dehydroabietate
    • Sodium [1R-(1alpha,4abeta,10aalpha)]-1,2,3,4,4a,9,10,10a-octahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate
    • EINECS 248-873-9
    • SCHEMBL15550582
    • Q27283881
    • UNII-MCO4K53W9N
    • 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodium salt (1:1), (1R,4aS,10aR)-
    • Inchi： 1S/C20H28O2.Na/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22);/q;+1/p-1/t17-,19-,20-;/m1./s1
    • InChI Key： ZCSNFGCDVJGPDD-YGJXXQMASA-M
    • SMILES： [Na+].[O-]C([C@]1(C)CCC[C@]2(C)C3C=CC(C(C)C)=CC=3CC[C@H]21)=O

Computed Properties

  • Exact Mass: 322.190875
  • Monoisotopic Mass: 322.190875
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 2
  • Complexity: 449
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 40.1

Experimental Properties

  • Boiling Point: 425.1°Cat760mmHg
  • Flash Point: 202.5°C

1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)- Related Literature

28161-39-9 (1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, sodiumsalt (1:1), (1R,4aS,10aR)-) Related Products

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