5'-Methoxylaudanosine supplier

Name
5'-Methoxylaudanosine
EINECS
CAS No. 24734-71-2
Article Data4
CAS DataBase
Density 1.121 g/cm³
Solubility
Melting Point
Formula C₂₂H₂₉NO₅
Boiling Point 492.6 °C at 760 mmHg
Molecular Weight 387.476
Flash Point 136.2 °C
Transport Information
Appearance Brown Oil
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Isoquinoline,1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)- (8CI);(?à)-5'-Methoxylaudanosine;
PSA 49.39000
LogP 3.43920

5'-Methoxylaudanosine Specification

The 5'-Methoxylaudanosine, with the CAS registry number 24734-71-2, has the systematic name of 6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline. It is a kind of brown oil, and belongs to the product categories of Aromatics and Heterocycles. And the molecular formula of the chemical is C₂₂H₂₉NO₅.

The characteristics of this chemical are as followings: (1)ACD/LogP: 3.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.15; (4)ACD/LogD (pH 7.4): 2.83; (5)#H bond acceptors: 6; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 7; (8)Polar Surface Area: 49.39 Å²; (9)Index of Refraction: 1.544; (10)Molar Refractivity: 109.26 cm³; (11)Molar Volume: 345.6 cm³; (12)Polarizability: 43.31×10^-24cm³; (13)Surface Tension: 39 dyne/cm; (14)Density: 1.121 g/cm³; (15)Flash Point: 136.2 °C; (16)Enthalpy of Vaporization: 75.96 kJ/mol; (17)Boiling Point: 492.6 °C at 760 mmHg; (18)Vapour Pressure: 7.56E-10 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CN1CCc2cc(c(cc2C1Cc3cc(c(c(c3)OC)OC)OC)OC)OC
(2)InChI: InChI=1/C22H29NO5/c1-23-8-7-15-12-18(24-2)19(25-3)13-16(15)17(23)9-14-10-20(26-4)22(28-6)21(11-14)27-5/h10-13,17H,7-9H2,1-6H3
(3)InChIKey: ALQIPWOCCJXSKZ-UHFFFAOYAQ

Product Name

5'-Methoxylaudanosine

5'-Methoxylaudanosine Specification

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