-
Name
2-({4,7-dimethoxy-5-[(2E)-3-phenylprop-2-enoyl]-1-benzofuran-6-yl}oxy)-N,N-diethylethanaminium (2Z)-3-carboxyprop-2-enoate
- EINECS
- CAS No. 26270-62-2
- Density
- Solubility
- Melting Point
- Formula C25H29NO5•C4H4O4
- Boiling Point 580.6°C at 760 mmHg
- Molecular Weight 539.63
- Flash Point 305°C
- Transport Information
- Appearance
- Safety Poison by ingestion and intravenous routes. When heated to decomposition it emits toxic fumes of NOx.
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate Chemical Properties
IUPAC Name: 2-[[4,7-Dimethoxy-5-[(E)-3-phenylprop-2-enoyl]-1-benzofuran-6-yl]oxy]ethyl-diethylazanium; (Z)-4-hydroxy-4-oxobut-2-enoate
Following is the structure of 6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate (CAS NO.26270-62-2):
Empirical Formula: C29H33NO9
Molecular Weight: 539.5736 g/mol
Enthalpy of Vaporization: 86.85 kJ/mol
Boiling Point: 580.6 °C at 760 mmHg
Flash Point of 6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate (CAS NO.26270-62-2): 305 °C
Vapour Pressure 6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate (CAS NO.26270-62-2): 1.78E-13 mmHg at 25 °C
Canonical SMILES: CC[NH+](CC)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)C=CC3=CC=CC=C3)OC)OC.C(=CC(=O)[O-])C(=O)O
Isomeric SMILES: CC[NH+](CC)CCOC1=C(C2=C(C=CO2)C(=C1C(=O)/C=C/C3=CC=CC=C3)OC)OC.C(=C\C(=
O)[O-])\C(=O)O
InChI: InChI=1S/C25H29NO5.C4H4O4/c1-5-26(6-2)15-17-31-24-21(20(27)13-12-18-10-8-7-9-11-18)22(28-3)19-14-16-30-23(19)25(24)29-4;5-3(6)1-2-4(7)8/h7-14,16H,5-6,15,17H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b13-12+;2-1-
InChIKey: DUVPOUVPDKJEBT-AFXJGQRRSA-N
6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate Toxicity Data With Reference
| 1. | orl-mus LD50:150 mg/kg | CHTPBA Chimica Therapeutica. 8 (1973),479. | ||
| 2. | ivn-mus LD50:11 mg/kg | CHTPBA Chimica Therapeutica. 8 (1973),479. |
6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate Safety Profile
Poison by ingestion and intravenous routes. When heated to decomposition, 6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate emits toxic fumes of NOx.
6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate Specification
6-(2-Diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoylbenzofuran maleate , its cas register number is 26270-62-2. It also can be called Cinnamoyl-5 dimethoxy-4,7 diethylaminoethoxy-6 benzofuranne maleate ; and Benzofuran, 6-(2-diethylaminoethoxy)-4,7-dimethoxy-5-cinnamoyl-, maleate .
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