Cas no 25800-63-9 (1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)-)

1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)- structure
25800-63-9 structure
Product Name:1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)-
CAS No:25800-63-9
MF:C20H34O2
MW:306.482766628265
CID:288168
PubChem ID:95347
Update Time:2025-04-19

1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)-
    • 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthrene-1-carboxylic acid
    • abietan-18-oic acid
    • Tetradecahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylic acid
    • TetrahydroabieticAcid(Stereoisomer)
    • NSC 2981
    • NS00048398
    • DTXSID50948706
    • NSC-2981
    • Abietan-18-oic acid #
    • TETRADECAHYDRO-7-ISOPROPYL-1.BETA.,4A.BETA.-DIMETHYLPHENANTHRENE-1-CARBOXYLIC ACID
    • EINECS 247-270-8
    • 1, 4a-dimethyl-7-propan-2-yl-2, 3, 4, 4b, 5, 6, 7, 8, 8a, 9, 10, 10a-dodecahydrophenanthrene-1-carboxylic acid
    • 25800-63-9
    • Tetrahydroabietic acid
    • SCHEMBL12547269
    • NSC2981
    • 7-Isopropyl-1,4a-dimethyltetradecahydrophenanthrene-1-carboxylic acid
    • Inchi： 1S/C20H34O2/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/h13-17H,5-12H2,1-4H3,(H,21,22)
    • InChI Key： YPGLTKHJEQHKSS-UHFFFAOYSA-N
    • SMILES： OC(C1(C)CCCC2(C)C1CCC1CC(C(C)C)CCC21)=O

Computed Properties

  • Exact Mass: 306.25602
  • Monoisotopic Mass: 306.25588
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 443
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 6
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 6.6
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.995
  • Melting Point: Not available
  • Boiling Point: 413.3°Cat760mmHg
  • Flash Point: 199.8°C
  • Refractive Index: 1.495
  • PSA: 37.3
  • Solubility: Not determined
  • Vapor Pressure: 0.0±2.1 mmHg at 25°C

1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)- Security Information

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25800-63-9 (1-Phenanthrenecarboxylicacid, tetradecahydro-1,4a-dimethyl-7-(1-methylethyl)-) Related Products

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