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Product Name: Dihydrohelenalin (CAS NO.34257-95-9)
Molecular Formula: C15H20O4
Molecular Weight: 264.3169g/mol
Mol File: 34257-95-9.mol
Boiling point: 451.4 °C at 760 mmHg
Storage Temperature:
Flash Point: 169.5 °C
Density: 1.192 g/cm3
Surface Tension: 41.1 dyne/cm
Enthalpy of Vaporization: 81.97 kJ/mol
Vapour Pressure: 4.77E-10 mmHg at 25°C
XLogP3-AA: 0.5
H-Bond Donor: 1
H-Bond Acceptor: 4
Tautomer Count 6
Topological Polar Surface Area: 63.6
Heavy Atom Count: 19
Complexity: 469
Defined Atom StereoCenter Count: 7
1. | dni-mus:ast 2143 µmol/L | JPMSAE Journal of Pharmaceutical Sciences. 67 (1978),1235. | ||
2. | orl-mus LD50:123 mg/kg | PLMEAA Planta Medica. 45 (1982),131. | ||
3. | ipr-mus LD50:31 mg/kg | PLMEAA Planta Medica. 45 (1982),131. |
Poison by ingestion and intraperitoneal routes. Mutation data reported.
Dihydrohelenalin ,its CAS NO. is 34257-95-9,the synonyms is Plenolin ; 11,13-Dihydrohelenalin ; (3aS)-4,4a,7aα,8,9,9aα-Hexahydro-4α-hydroxy-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5(3H,3aαH)-dione ; (3S)-3,3aα,4,4a,7aα,8,9,9aα-Octahydro-4α-hydroxy-3β,4aβ,8α-trimethylazuleno[6,5-b]furan-2,5-dione ; (3S)-3β,4aβ,8α-Trimethyl-4α-Hydroxy-3,3aα,4,4a,7aα,8,9,9aα-octahydroazuleno[6,5-b]furan-2,5-dione .