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Ethyl α-oxo-1H-indole-3-acetate

Ethyl α-oxo-1H-indole-3-acetate structure

Ethyl α-oxo-1H-indole-3-acetate 

structure
  • CAS No:

    51079-10-8

  • Formula:

    C12H11NO3

  • Chemical Name:

    Ethyl α-oxo-1H-indole-3-acetate

  • Synonyms:

    1H-Indole-3-acetic acid,α-oxo-,ethyl ester;Indole-3-glyoxylic acid,ethyl ester;Ethyl α-oxo-1H-indole-3-acetate;Ethyl indole-3-glyoxylate;NSC 402543;Ethyl 2-(1H-indol-3-yl)-2-oxoacetate;Ethyl 3-indolylglyoxylate

Ethyl α-oxo-1H-indole-3-acetate Basic Attributes

217.22100

217.22

256-954-5

6U8Q4H6QFU

402543

DTXSID40199083

Characteristics

59.16000

1.91370

1.278g/cm3

185-186 °C

391.7ºC

190.7ºC

1.618

Safety Information

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:217.22
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:217.07389321
Monoisotopic Mass:217.07389321
Topological Polar Surface Area:59.2
Heavy Atom Count:16
Complexity:290
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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