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Home > Encyclopedia > 2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid structure

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid 

structure
  • CAS No:

    524035-97-0

  • Formula:

    C17H15NO2S

  • Chemical Name:

    2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid

  • Synonyms:

    Acetic acid,2-[[1-(phenylmethyl)-1H-indol-3-yl]thio]-;Acetic acid,[[1-(phenylmethyl)-1H-indol-3-yl]thio]-;2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid;1-Benzyl-3-indolylthioacetic acid;[(1-Benzyl-1H-indol-3-yl)thio]acetic acid;(1-Benzyl-1H-indol-3-ylsulfanyl)-acetic acid;2-((1-Benzyl-1H-indol-3-yl)thio)acetic acid

2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid Basic Attributes

297.37

297.37

2933990090

Characteristics

67.5

3.7

1.23g/cm3

103-106 °C

539.5ºC at 760 mmHg

280.1ºC

1.64

>44.6 [ug/mL]

Computed Properties

Molecular Weight:297.4
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:297.08234989
Monoisotopic Mass:297.08234989
Topological Polar Surface Area:67.5
Heavy Atom Count:21
Complexity:357
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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