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| CAS No.: | 13063-54-2 |
|---|---|
| Name: | (R)-(+)-Corypalmine |
| Molecular Structure: | |
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| Formula: | C20H23NO4 |
| Molecular Weight: | 341.407 |
| Synonyms: | Tetrahydrojateorrhizine;6H-Dibenzo(a,g)quinolizin-3-ol, 5,8,13,13a-tetrahydro-2,9,10-trimethoxy-;2,9,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolin-3-ol; |
| Density: | 1.29 g/cm3 |
| Boiling Point: | 501.2 °C at 760 mmHg |
| Flash Point: | 256.9 °C |
| PSA: | 51.16000 |
| LogP: | 3.01140 |
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- Total:37 Page 1 of 1 1
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Specification
The CAS register number of (R)-(+)-Corypalmine is 13063-54-2. It also can be called as 2,9,10-Trimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolin-3-ol and the IUPAC name about this chemical is 2,9,10-trimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-3-ol. The molecular formula about this chemical is C20H23NO4 and the molecular weight is 341.40.
Physical properties about (R)-(+)-Corypalmine are: (1)ACD/LogP: 2.93; (2)ACD/LogD (pH 5.5): 1.9; (3)ACD/LogD (pH 7.4): 2.88; (4)ACD/BCF (pH 5.5): 9.2; (5)ACD/BCF (pH 7.4): 88.5; (6)ACD/KOC (pH 5.5): 86.5; (7)ACD/KOC (pH 7.4): 832.47; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 40.16Å2; (12)Index of Refraction: 1.64; (13)Molar Refractivity: 95 cm3; (14)Molar Volume: 263.5 cm3; (15)Polarizability: 37.66x10-24cm3; (16)Surface Tension: 59 dyne/cm; (17)Enthalpy of Vaporization: 79.91 kJ/mol; (18)Boiling Point: 501.2 °C at 760 mmHg; (19)Vapour Pressure: 1.14E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1c4c(ccc1OC)CC3c2c(cc(O)c(OC)c2)CCN3C4)C(2)InChI: InChI=1/C20H23NO4/c1-23-18-5-4-12-8-16-14-10-19(24-2)17(22)9-13(14)6-7-21(16)11-15(12)20(18)25-3/h4-5,9-10,16,22H,6-8,11H2,1-3H3
(3)InChIKey: BMCZTYDZHNTKPR-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C20H23NO4/c1-23-18-5-4-12-8-16-14-10-19(24-2)17(22)9-13(14)6-7-21(16)11-15(12)20(18)25-3/h4-5,9-10,16,22H,6-8,11H2,1-3H3
(5)Std. InChIKey: BMCZTYDZHNTKPR-UHFFFAOYSA-N