2-(3-Formylindol-1-yl)-N-(2-furylmethyl)acetamide supplier

Name
2-(3-FORMYL-INDOL-1-YL)-N-FURAN-2-YLMETHYL-ACETAMIDE
EINECS
CAS No. 347319-95-3
Density 1.27 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₄N₂O₃
Boiling Point 570.8 °C at 760 mmHg
Molecular Weight 282.299
Flash Point 299 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(3-Formyl-indol-1-yl)-N-furan-2-ylmethyl-acetamide;
PSA 64.24000
LogP 2.75410

2-(3-Formylindol-1-yl)-N-(2-furylmethyl)acetamide Specification

The 2-(3-Formylindol-1-yl)-N-(2-furylmethyl)acetamide, with the CAS registry number of 347319-95-3, is also known as 2-(3-Formyl-indol-1-yl)-N-furan-2-ylmethyl-acetamide. This chemical's molecular formula is C₁₆H₁₄N₂O₃ and molecular weight is 282.29. What's more, its IUPAC name is 2-(3-Formylindol-1-yl)-N-(furan-2-ylmethyl)acetamide.

Physical properties about 2-(3-Formylindol-1-yl)-N-(2-furylmethyl)acetamide are: (1)ACD/LogP: 1.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.65; (4)ACD/LogD (pH 7.4): 1.65; (5)ACD/BCF (pH 5.5): 10.5; (6)ACD/BCF (pH 7.4): 10.5; (7)ACD/KOC (pH 5.5): 187.32; (8)ACD/KOC (pH 7.4): 187.32; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.45 Å²; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 78.73 cm³; (15)Molar Volume: 221.2 cm³; (16)Polarizability: 31.21×10^-24 cm³; (17)Surface Tension: 51.3 dyne/cm; (18)Density: 1.27 g/cm³; (19)Flash Point: 299 °C; (20)Enthalpy of Vaporization: 85.61 kJ/mol; (21)Boiling Point: 570.8 °C at 760 mmHg; (22)Vapour Pressure: 4.85E-13 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(NCc1occc1)Cn3c2ccccc2c(C=O)c3
(2) InChI: InChI=1/C16H14N2O3/c19-11-12-9-18(15-6-2-1-5-14(12)15)10-16(20)17-8-13-4-3-7-21-13/h1-7,9,11H,8,10H2,(H,17,20)
(3) InChIKey: SIMWOBHMICDZEH-UHFFFAOYAS

Product Name

2-(3-FORMYL-INDOL-1-YL)-N-FURAN-2-YLMETHYL-ACETAMIDE

2-(3-Formylindol-1-yl)-N-(2-furylmethyl)acetamide Specification

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