Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Ethyl (3-formyl-1H-indol-1-yl)acetate |
EINECS | N/A |
CAS No. | 27065-94-7 | Density | 1.18 g/cm3 |
PSA | 48.30000 | LogP | 2.01690 |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H13NO3 | Boiling Point | 397.5 °C at 760 mmHg |
Molecular Weight | 231.25 | Flash Point | 194.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
3-Formyl-1h-indole-1-acetic acid ethyl ester;(3-Formyl-indol-1-yl)-acetic acid ethyl ester;Ethyl (3-formyl-indol-1-yl)-acetate; |
Article Data | 17 |
The CAS register number of Ethyl (3-formyl-1H-indol-1-yl)acetate is 27065-94-7. It also can be called as 3-Formyl-1h-indole-1-acetic acid ethyl ester. The molecular formula about this chemical is C13H13NO3 and the molecular weight is 231.25.
Physical properties about Ethyl (3-formyl-1H-indol-1-yl)acetate are: (1)ACD/LogP: 2.37; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 48.3 Å2; (5)Index of Refraction: 1.569; (6)Molar Refractivity: 64.22 cm3; (7)Molar Volume: 195.8 cm3; (8)Polarizability: 25.45x10-24cm3; (9)Surface Tension: 43.7 dyne/cm; (10)Density: 1.18 g/cm3; (11)Flash Point: 194.2 °C; (12)Enthalpy of Vaporization: 64.8 kJ/mol; (13)Boiling Point: 397.5 °C at 760 mmHg; (14)Vapour Pressure: 1.58E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2c1ccccc1n(c2)CC(=O)OCC
(2)InChI: InChI=1/C13H13NO3/c1-2-17-13(16)8-14-7-10(9-15)11-5-3-4-6-12(11)14/h3-7,9H,2,8H2,1H3
(3)InChIKey: YBKKLZGZHIBOBZ-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C13H13NO3/c1-2-17-13(16)8-14-7-10(9-15)11-5-3-4-6-12(11)14/h3-7,9H,2,8H2,1H3
(5)Std. InChIKey: YBKKLZGZHIBOBZ-UHFFFAOYSA-N