Olean-12-ene-3,11-dione supplier

Name
18BETA(H)-OLEAN-12-ENE-3,11-DIONE
EINECS
CAS No. 2935-32-2
Article Data4
CAS DataBase
Density 1.05 g/cm³
Solubility
Melting Point 228-231 °C
Formula C₃₀H₄₆O₂
Boiling Point 521.9 °C at 760 mmHg
Molecular Weight 438.694
Flash Point 192.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3,11-Dioxo-b-amyrene;3,11-Dioxoolean-12-ene;
PSA 34.14000
LogP 7.55610

Olean-12-ene-3,11-dione Specification

The Olean-12-ene-3,11-dione, with the CAS registry number 2935-32-2, is also known as 3,11-dioxo-β-amyrene. This chemical's molecular formula is C₃₀H₄₆O₂ and molecular weight is 438.68. Its systematic name is called olean-12-ene-3,11-dione.

Physical properties of Olean-12-ene-3,11-dione: (1)ACD/LogP: 8.37; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.37; (4)ACD/LogD (pH 7.4): 8.37; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 852060.56; (8)ACD/KOC (pH 7.4): 852060.56; (9)#H bond acceptors: 2; (10)Index of Refraction: 1.539; (11)Molar Refractivity: 130.64 cm³; (12)Molar Volume: 416.5 cm³; (13)Surface Tension: 40.3 dyne/cm; (14)Density: 1.05 g/cm³; (15)Flash Point: 192.3 °C; (16)Enthalpy of Vaporization: 79.52 kJ/mol; (17)Boiling Point: 521.9 °C at 760 mmHg; (18)Vapour Pressure: 5.45E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C[C@@]12CC[C@@]3(C(=CC(=O)[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)[C@@H]1CC(CC2)(C)C)C
(2)InChI: InChI=1/C30H46O2/c1-25(2)13-14-27(5)15-16-29(7)19(20(27)18-25)17-21(31)24-28(6)11-10-23(32)26(3,4)22(28)9-12-30(24,29)8/h17,20,22,24H,9-16,18H2,1-8H3/t20-,22-,24+,27+,28-,29+,30+/m0/s1
(3)InChIKey: XQIVDOSRZQSWFL-QKMNFNRLBQ

Product Name

18BETA(H)-OLEAN-12-ENE-3,11-DIONE

Olean-12-ene-3,11-dione Specification

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