Cas no 596-85-0 (Manool)

Manool structure
Manool structure
Product Name:Manool
CAS No:596-85-0
MF:C20H34O
MW:290.48336648941
CID:38657
PubChem ID:3034394
Update Time:2025-04-18

Manool Chemical and Physical Properties

Names and Identifiers

    • Manool
    • (4aR)-trans-5-(1,5,5,8aS-Tetramethyl-2-methylenedecahydro-1-naphthalenyl)-(3R)-methyl-1-penten-3-ol
    • (αR,1S,4aS,8aS)-α-Ethenyldecahydro-α,5,5,8a-tetraMethyl-2-Methylene-1-napthalenepropanol
    • 8,14-labdadien-13-ol
    • SR-05000002258
    • 596-85-0
    • 1-Naphthalenepropanol, .alpha.-ethenyldecahydro-.alpha.,5,5,8a-tetramethyl-2-methylene-, (4aS)-
    • SCHEMBL12658773
    • (13R)-manool
    • Q15726184
    • Labda-8(20),14-dien-13-ol, (13R)-
    • CHEBI:76945
    • CCG-208417
    • Labda-8 (20),14-dien-13-ol, (13R)-
    • (.ALPHA.R,1S,4AS,8AS)-.ALPHA.-ETHENYLDECAHYDRO-.ALPHA.,5,5,8A-TETRAMETHYL-2-METHYLENE-1-NAPHTHALENEPROPANOL
    • labda-8(17),14-dien-13(R)-ol
    • (3R)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methyl-pent-1-en-3-ol
    • (3R)-3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-1-en-3-ol
    • (13R)-Labda-8(20),14-dien-13-ol
    • (3R)-3-methyl-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl]pent-1-en-3-ol
    • MS-24149
    • (13R)-labda-8(27),14-dien-13-ol
    • HY-N1039A
    • (3R)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
    • 1-Naphthalenepropanol, .alpha.-ethenyldecahydro-.alpha.,5,5,8a-tetramethyl-2-methylene-, (.alpha.R,1S,4aS,8aS)-
    • (+)-manool
    • (3R)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]-3-methylpent-1-en-3-ol
    • NSC-165961
    • AT5PJ0PV00
    • (5S,9S,10S,13R)-labda-8(17),14-dien-13-ol
    • NSC165961
    • SR-05000002258-2
    • CHEMBL4162501
    • CS-0132370
    • (R)-3-methyl-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-1-en-3-ol
    • ent-labda-8(17),14-dien-13R-ol
    • Q27146465
    • (13S)-ent-manool
    • (3S)-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
    • CHEBI:76948
    • ent-manool
    • (3S)-3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl]pent-1-en-3-ol
    • CHEBI:76944
    • (5S,9S,10S,13S)-labda-8(17),14-dien-13-ol
    • FS-9514
    • (3S)-3-methyl-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-1-en-3-ol
    • CECREIRZLPLYDM-RAUXBKROSA-N
    • Epimanool
    • CS-0016303
    • (3S)-3-methyl-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl]pent-1-en-3-ol
    • (13S)-manool
    • AKOS032962540
    • 13-Epimanool
    • 1438-62-6
    • DTXSID4022072
    • Epi-13-Manool
    • 5-(5,5,8a-Trimethyl-2-methylenedecahydro-1-naphthalenyl)-3-methyl-1-penten-3-ol #
    • HY-N1039
    • Q27146459
    • CHEMBL561922
    • 13-epi-manool
    • labda-8(17),14-dien-13(S)-ol
    • (3S)-5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-1-en-3-ol
    • (S)-3-Methyl-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-1-en-3-ol
    • (13S)-labda-8(17),14-dien-13-ol
    • SCHEMBL248885
    • CECREIRZLPLYDM-OQLBXJDTSA-N
    • Labda-8(20),14-dien-13-ol, (13S)-
    • NSC 165961
    • NSC 666751
    • UNII-AT5PJ0PV00
    • 1-Naphthalenepropanol, alpha-ethenyldecahydro-alpha,5,5,8a-tetramethyl-2-methylene-, (1S-(1alpha(S*),4abeta,8aalpha))-
    • 1-Naphthalenepropanol, .alpha.-ethenyldecahydro-.alpha.,5,5,8a-tetramethyl-2-methylene-, [1S-[1.alpha.(R*),4a.beta.,8a.alpha.]]-
    • SCHEMBL18371731
    • Labd-8(17),14-dien-13-ol
    • 1-Naphthalenepropanol, alpha-ethenyldecahydro-alpha,5,5,8a-tetramethyl-2-methylene-, (1S-(1alpha(S*),4abeta,8aalpha))-(9CI)
    • (3R)-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-1-en-3-ol
    • Mannool
    • (ALPHAR,1S,4AS,8AS)-ALPHA-ETHENYLDECAHYDRO-ALPHA,5,5,8A-TETRAMETHYL-2-METHYLENE-1-NAPHTHALENEPROPANOL
    • 1-Naphthalenepropanol, .alpha.-ethenyldecahydro-.alpha.,5,5,8a-tetramethyl-2-methylene-, [1S-[1.alpha.(S*),4a.beta.,8a.alpha.]]-
    • FM65852
    • (3R)-3-methyl-5-((1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl)pent-1-en-3-ol
    • (3R)-3-methyl-5-((1S,4aS,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl)pent-1-en-3-ol
    • CECREIRZLPLYDM-QGZVKYPTSA-N
    • DTXCID102072
    • 1-NAPHTHALENEPROPANOL, ALPHA-ETHENYLDECAHYDRO-ALPHA,5,5,8A-TETRAMETHYL-2-METHYLENE-, (ALPHAR,1S,4AS,8AS)-
    • Inchi： 1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17-,19-,20+/m0/s1
    • InChI Key： CECREIRZLPLYDM-QGZVKYPTSA-N
    • SMILES： O[C@](C=C)(C)CC[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@@]21C

Computed Properties

  • Exact Mass: 290.26100
  • Monoisotopic Mass: 290.261
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 422
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 5.7
  • Topological Polar Surface Area: 20.2

Experimental Properties

  • Density: 0.9±0.1 g/cm3
  • Melting Point: 49-52 oC
  • Boiling Point: 368.2±11.0 °C at 760 mmHg
  • Flash Point: >230?°F
  • Refractive Index: 1.5
  • PSA: 20.23000
  • LogP: 5.50240
  • Vapor Pressure: 0.0±1.9 mmHg at 25°C

Manool Security Information

Manool Pricemore >>

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