Product Name

  • Name

    Phlebiakauranol aldehyde

  • EINECS
  • CAS No. 57743-92-7
  • Density 1.35g/cm3
  • Solubility
  • Melting Point
  • Formula C20H30 O6
  • Boiling Point 556.4°Cat760mmHg
  • Molecular Weight 366.50
  • Flash Point 304.4°C
  • Transport Information
  • Appearance
  • Safety Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
  • Risk Codes
  • Molecular Structure Molecular Structure of 57743-92-7 (Phlebiakauranol aldehyde)
  • Hazard Symbols
  • Synonyms 1H-2,10a-Ethanophenanthrene,kauran-17-al deriv.; Phlebiakauranol aldehyde
  • PSA
  • LogP

Phlebiakauranol aldehyde Chemical Properties

Molecular Structure of Phlebiakauranol aldehyde (CAS NO. 57743-92-7):

Systematic Name: Kauran-17-al, 9, 12,13,16-tetrahydroxy-11-oxo-, (12-alpha)-
Molecular Formula: C20H30O6
Molecular Weight: 366.448600 g/mol
XLogP3-AA: 1.4
H-Bond Donor: 4
H-Bond Acceptor: 6
Isomeric SMILES: C[C@@]12CCCC([C@H]1CCC34[C@]2(C(=O)[C@@H]([C@@](C3)([C@](C4)(C=O)O)O)O)O)(C)C
InChI: InChI=1S/C20H30O6/c1-15(2)6-4-7-16(3)12(15)5-8-17-9-18(24,11-21)19(25,10-17)13(22)14(23)20(16,17)26/h11-13,22,24-26H,4-10H2,1-3H3/t12-,13+,16-,17?,18+,19+,20-/m1/s1
InChIKey: YRNWJHCNUMMHJM-NWNIPPRCSA-N
Index of Refraction: 1.607
Molar Refractivity: 93.08 cm3
Molar Volume: 269.4 cm3
Polarizability: 36.9 × 10-24 cm3
Surface Tension: 66.2 dyne/cm
Density: 1.35 g/cm3
Flash Point: 304.4 °C
Enthalpy of Vaporization: 96.3 kJ/mol
Boiling Point: 556.4 °C at 760 mmHg
Vapour Pressure of Phlebiakauranol aldehyde (CAS NO. 57743-92-7): 1.07E-14 mmHg at 25 °C

Phlebiakauranol aldehyde Toxicity Data With Reference

1.    

dni-uns 48 mg/L

     JANTAJ    Journal of Antibiotics. 40 (1987),443.
2.    

uns-uns 38 mg/L

     JANTAJ    Journal of Antibiotics. 40 (1987),443.
3.    

uns-uns 12 mg/L

     JANTAJ    Journal of Antibiotics. 40 (1987),443.
4.    

dni-mus ast 9 mg/L

     JANTAJ    Journal of Antibiotics. 40 (1987),443.
5.    

uns-mus ast 8 mg/L

     JANTAJ    Journal of Antibiotics. 40 (1987),443.

Phlebiakauranol aldehyde Safety Profile

Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.

Phlebiakauranol aldehyde Specification

  Phlebiakauranol aldehyde with cas registry number of 57743-92-7 is also called for 11-Oxo-9,12-alpha,13,17-tetrahydroxykauran-17(S)-al ; 1H-2,10a-Ethanophenanthrene, kauran-17-al deriv. ; Kauran-17-al, 9, 12,13,16-tetrahydroxy-11-oxo-, (12-alpha)- ; Kauran-17-al, 9,12,13,16-tetrahydroxy-11-oxo-, (12alpha)-(9CI) .

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