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