4-Methoxy-1-methoxycarbonyl-beta-carboline supplier

Name
4-Methoxy-1-methoxycarbonyl-beta-carboline
EINECS
CAS No. 60807-25-2
Article Data3
CAS DataBase
Density 1.34 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₂N₂O₃
Boiling Point 509.1 °C at 760 mmHg
Molecular Weight 256.256680
Flash Point 261.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms W1176;
PSA 64.21000
LogP 2.51130

4-Methoxy-1-methoxycarbonyl-beta-carboline Specification

The 4-Methoxy-1-methoxycarbonyl-beta-carboline, with the CAS registry number 60807-25-2, has the IUPAC name methyl 4-methoxy-9H-β-carboline-1-carboxylate. Its molecular formula is C₁₄H₁₂N₂O₃and its molecular weight is 256.256680 .

Other characteristics of the 4-Methoxy-1-methoxycarbonyl-beta-carboline can be summarised as followings: (1)ACD/LogP: 3.08; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 53.35 Å²; (7)Index of Refraction: 1.688; (8)Molar Refractivity: 72.91 cm³; (9)Molar Volume: 191.1 cm³; (10)Polarizability: 28.9×10^-24cm³; (11)Surface Tension: 59.2 dyne/cm; (12)Density: 1.34 g/cm³; (13)Flash Point: 261.7 °C; (14)Enthalpy of Vaporization: 77.96 kJ/mol; (15)Boiling Point: 509.1 °C at 760 mmHg; (16)Vapour Pressure: 1.74E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC)c3ncc(OC)c2c1c(cccc1)nc23
2.InChI: InChI=1/C14H12N2O3/c1-18-10-7-15-13(14(17)19-2)12-11(10)8-5-3-4-6-9(8)16-12/h3-7,16H,1-2H3
3.InChIKey: WNNUGSXDGKSRRG-UHFFFAOYAV

Product Name

4-Methoxy-1-methoxycarbonyl-beta-carboline

4-Methoxy-1-methoxycarbonyl-beta-carboline Specification

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