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205873-58-1

Basic Information
CAS No.: 205873-58-1
Name: Indole-7-carboxylic acid ethyl ester
Article Data: 5
Molecular Structure:
Molecular Structure of 205873-58-1 (Indole-7-carboxylic acid ethyl ester)
Formula: C11H11NO2
Molecular Weight: 189.214
Synonyms: Indole-7-carboxylic acid ethyl ester; Ethyl indole-7-carboxylate;
Density: 1.211 g/cm3
Boiling Point: 342.357 °C at 760 mmHg
Flash Point: 160.852 °C
PSA: 42.09000
LogP: 2.34460
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  • SHANGHAI ZZBIO CO., LTD.

    China (Mainland)  |  Contact Details

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    Tel:86-21-68404353-215

    Address:Rm 710, 30 BLDG, 2419 Hu Nan RD., Pudong New Area, Shanghai, China

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  • Ethylindole-7-carboxylate

  • Casno:

    205873-58-1

    Ethylindole-7-carboxylate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Debyesci is here who supplied several kinds of chemical products to global pharmaceutical, drug discovery, agrochemical and biotechnology industries for four yearsOur key scientific leadership team has gained experience in top research and developmen

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  • Ethyl 1H-indole-7-carboxylate

  • Casno:

    205873-58-1

    Ethyl 1H-indole-7-carboxylate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    High quality Application:Pharmaceutial

    Chamflyer Chemicals Co.Ltd is a fine organics manufacturing facility which located in Shanghai. We produce a wide range of boronic acids, pyridines, quinolines, indoles, oxazoles,

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    Business Type:Lab/Research institutions

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    Address:No 38 Debao Road, Pudong New District, Shanghai

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  • Ethyl 1H-indole-7-carboxylate

  • Casno:

    205873-58-1

    Ethyl 1H-indole-7-carboxylate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    high purity Application:Drug intermediates Materials intermediates and active molecules

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Specification

The Indole-7-carboxylic acid ethyl ester, with the CAS registry number of 205873-58-1, is also known as 1H-Indole-7-carboxylicacid,ethylester(9CI). It belongs to the product category of Carboxylicester. This chemical's molecular formula is C11H11NO2 and molecular weight is 189.21. What's more, its systematic name is Ethyl 1H-indole-7-carboxylate.

Physical properties about the Indole-7-carboxylic acid ethyl ester are: (1)ACD/LogP: 3.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 61; (6)ACD/BCF (pH 7.4): 61; (7)ACD/KOC (pH 5.5): 660; (8)ACD/KOC (pH 7.4): 660; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.09 Å2; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 54.935 cm3; (15)Molar Volume: 156.271 cm3; (16)Surface Tension: 49.902 dyne/cm; (17)Density: 1.211 g/cm3; (18)Flash Point: 160.852 °C; (19)Enthalpy of Vaporization: 58.611 kJ/mol; (20)Boiling Point: 342.357 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CCOC(=O)c1cccc2ccnc12
(2) InChI: InChI=1/C11H11NO2/c1-2-14-11(13)9-5-3-4-8-6-7-12-10(8)9/h3-7,12H,2H2,1H3
(3) InChIKey: WZXGOHXFXHUJLR-UHFFFAOYAX