4A-Hydroxyavermectin B1 with CAS No.of 86629-72-3 is also called for 5-O-Demethyl-26-hydroxyavermectin A1a ; BRN 5473169 ; Avermectin A1a, 5-O-demethyl-26-hydroxy- ; CID6448355 ; LS-22270 ; 86629-72-3 and so on.
Molecular Weight: 889.07
Molecular Formula: C48H72O15
ACD/LogP: 6.05
ACD/LogD (pH 5.5): 6.05
ACD/LogD (pH 7.4): 6.05
ACD/BCF (pH 5.5): 23320.67
ACD/BCF (pH 7.4): 23320.27
ACD/KOC (pH 5.5): 46560.17
ACD/KOC (pH 7.4): 46559.35
H bond acceptors: 15
H bond donors: 4
Freely Rotating Bonds: 13
Heavy Atom Count: 63
Formal Charge: 0
Complexity: 1740
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 20
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 3
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Polar Surface Area: 146.29Å2
Index of Refraction: 1.578
Molar Refractivity: 232.17 cm3
Molar Volume: 698.8 cm3
Surface Tension: 55.3 dyne/cm
Density: 1.27 g/cm3
Flash Point: 277.2 °C
Enthalpy of Vaporization: 160.35 kJ/mol
Boiling Point: 970.9 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
The molecular structure of 4A-Hydroxyavermectin B1 with CAS No.of 86629-72-3:
4A-Hydroxyavermectin B1 (CAS No.86629-72-3) is used as agricultural chemical and insecticide.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 205mg/kg (205mg/kg) | Journal of Agricultural and Food Chemistry. Vol. 42, Pg. 1786, 1994. |
A poison by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
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