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| Name |
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a |
EINECS | N/A |
| CAS No. | 148865-08-1 | Density | 1.24g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C52H80 O17 | Boiling Point | 988.5°Cat760mmHg |
| Molecular Weight | 977.32 | Flash Point | 273.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Spiro[11,15-methano-2H,13H,17H-furo[4,3,2-pq][2,6]benzodioxacyclooctadecin-13,2'-[2H]pyran],avermectin A1a deriv. |
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a Chemical Properties
Following is the structure of 5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a (CAS NO.148865-08-1):
Empirical Formula: C52H80O17
Molecular Weight: 977.1814 g/mol
Surface Tension: 52.7 dyne/cm
Density: 1.24 g/cm3
Flash Point: 273.6 °C
Enthalpy of Vaporization: 163.34 kJ/mol
Boiling Point: 988.5 °C at 760 mmHg
Index of Refraction of 5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a (CAS NO.148865-08-1): 1.563
Canonical SMILES: CCC(C)C1C(C=CC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)CO)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)OCOCCOC)OC)OC)C)C
Isomeric SMILES: CCC(C)C1C(C=CC2(O1)CC3CC(O2)C/C=C(/C(C(/C=C/C=C/4\COC5C4(C(C=C(C5O)CO)C
(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)OCOCCOC)OC)OC)\C)C
InChI: InChI=1S/C52H80O17/c1-11-29(2)46-32(5)17-18-51(69-46)25-38-22-37(68-51)16-15-31(4)45(30(3)13-12-14-36-27-61-49-44(54)35(26-53)21-39(50(55)65-38)52(36,49)56)66-42-24-41(59-10)48(34(7)64-42)67-43-23-40(58-9)47(33(6)63-43)62-28-60-20-19-57-8/h12-15,17-18,21,29-30,32-34,37-49,53-54,56H,11,16,19-20,22-28H2,1-10H3/b13-12+,31-15+,36-14+
InChIKey: NNPPNOXHGOUBFW-NMCMTHAVSA-N
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a Toxicity Data With Reference
| 1. | orl-mus LD50:>100 mg/kg | JAFCAU Journal of Agricultural and Food Chemistry. 42 (1994),1786. |
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a Safety Profile
A poison by ingestion. When heated to decomposition, 5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a (CAS NO.148865-08-1) emits acrid smoke and irritating vapors.
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a Specification
5-O-Demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)avermectin A1a , its cas register number is 148865-08-1. It also can be called Avermectin A1a, 5-O-demethyl-26-hydroxy-4''-O-((2-methoxyethoxy)methyl)- . Its classification code are Agricultural Chemical and Insecticide.
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