1H-Indole-1-carboxylicacid, ethyl ester supplier

Name
ethyl 1H-indole-1-carboxylate
EINECS 236-335-6
CAS No. 13307-67-0
Article Data27
CAS DataBase
Density 1.13 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₁NO₂
Boiling Point 303.3 °C at 760 mmHg
Molecular Weight 189.214
Flash Point 137.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Indole-1-carboxylicacid, ethyl ester (8CI);1-(Carbethoxy)indole;1-(Ethoxycarbonyl)-1H-indole;Ethyl 1-indolecarboxylate;N-(Ethoxycarbonyl)indole;NSC 81240;
PSA 31.23000
LogP 2.64590

1H-Indole-1-carboxylicacid, ethyl ester Specification

The 1H-Indole-1-carboxylicacid, ethyl ester, with the CAS registry number 13307-67-0, is also known as Ethyl 1H-indole-1-carboxylate. Its EINECS registry number is 236-335-6. This chemical's molecular formula is C₁₁H₁₁NO₂ and molecular weight is 189.21054. Its IUPAC name is called ethyl indole-1-carboxylate.

Physical properties of 1H-Indole-1-carboxylicacid, ethyl ester: (1)ACD/LogP: 3.17; (2)ACD/LogD (pH 5.5): 3.17; (3)ACD/LogD (pH 7.4): 3.17; (4)ACD/BCF (pH 5.5): 149.85; (5)ACD/BCF (pH 7.4): 149.85; (6)ACD/KOC (pH 5.5): 1255.85; (7)ACD/KOC (pH 7.4): 1255.85; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.564; (11)Molar Refractivity: 54.15 cm³; (12)Molar Volume: 166.3 cm³; (13)Surface Tension: 41 dyne/cm; (14)Density: 1.13 g/cm³; (15)Flash Point: 137.3 °C; (16)Enthalpy of Vaporization: 54.36 kJ/mol; (17)Boiling Point: 303.3 °C at 760 mmHg; (18)Vapour Pressure: 0.000936 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=O)N1C=CC2=CC=CC=C21
(2)InChI: InChI=1S/C11H11NO2/c1-2-14-11(13)12-8-7-9-5-3-4-6-10(9)12/h3-8H,2H2,1H3
(3)InChIKey: OEXNQFWEJRSZBW-UHFFFAOYSA-N

Product Name

ethyl 1H-indole-1-carboxylate

1H-Indole-1-carboxylicacid, ethyl ester Specification

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