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| Name |
14-Acetyldictyocarpine |
EINECS | N/A |
| CAS No. | 75659-26-6 | Density | 1.35g/cm3 |
| PSA | 112.99000 | LogP | 1.20450 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C28H41 N O9 | Boiling Point | 614.7°C at 760 mmHg |
| Molecular Weight | 535.635 | Flash Point | 325.5°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by subcutaneous route. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
14-Acetyldictyocarpine;14-O-Acetyldictyocarpine; Dictyocarpine 14-acetate; Dictyocarpinine6,14-diacetate |
14-Acetyldictyocarpine Chemical Properties
Chemistry informtion about 14-Acetyldictyocarpine(CAS NO.75659-26-6) is:
Synonyms: Aconitane-6,10,14-triol, 1,16-dimethoxy-20-ethyl-4-methyl-7,8-(methylenebis(oxy))-, 6,14-diacetate, (1-alpha,6-beta,14-alpha,16-beta)- Molecular Weight: 535.62644 [g/mol]
Molecular Formula: C28H41NO9
XLogP3-AA: 0.6
H-Bond Donor: 1
H-Bond Acceptor: 10
Density: 1.35 g/cm3
Flash Point: 325.5 °C
Enthalpy of Vaporization: 104.59 kJ/mol
Boiling Point: 614.7 °C at 760 mmHg
Vapour Pressure: 1.11E-17 mmHg at 25°C
Following is the molecular structure of 14-Acetyldictyocarpine(CAS NO.75659-26-6) is:
14-Acetyldictyocarpine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LDLo | subcutaneous | 765mg/kg (765mg/kg) | behavioral: ataxia | Journal of Agricultural and Food Chemistry. Vol. 41, Pg. 96, 1993. |
14-Acetyldictyocarpine Safety Profile
Moderately toxic by subcutaneous route. When heated to decomposition it emits toxic vapors of NOx.
14-Acetyldictyocarpine Specification
Descriptors Computed from Structure about 14-Acetyldictyocarpine(CAS NO.75659-26-6) is:
Canonical SMILES: CCN1CC2(CCC(C34C2C(C5(C31)C6(CC(C7CC4(C6C7OC(=O)C)O)OC)OCO5)OC(=O)C)OC)C
InChI: InChI=1S/C28H41NO9/c1-7-29-12-24(4)9-8-18(34-6)27-21(24)22(38-15(3)31)28(23(27)29)26(35-13-36-28)11-17(33-5)16-10-25(27,32)20(26)19(16)37-14(2)30/h16-23,32H,7-13H2,1-6H3
InChIKey: YRFHHBLWWCMRSY-UHFFFAOYSA-N
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