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Home > Encyclopedia > 2-(1-benzothien-2-yl)propanoic acid

2-(1-benzothien-2-yl)propanoic acid

2-(1-benzothien-2-yl)propanoic acid structure

2-(1-benzothien-2-yl)propanoic acid 

structure
  • CAS No:

    85494-05-9

  • Formula:

    C11H10O2S

  • Chemical Name:

    2-(1-benzothien-2-yl)propanoic acid

  • Synonyms:

    2-(1-benzothiophen-2-yl)propanoic acid;2-(1-benzothien-2-yl)propanoic acid;Oprea1_134068;AI-942/13331527;SCHEMBL5542170;MCULE-4524430908;85494-05-9;Benzo[b]thiophene-2-acetic acid, alpha-methyl-

2-(1-benzothien-2-yl)propanoic acid Basic Attributes

206.2609

206.04

Characteristics

65.5

3

134 - 136 °C (petroleum ether)

Computed Properties

Molecular Weight:206.26
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:206.04015073
Monoisotopic Mass:206.04015073
Topological Polar Surface Area:65.5
Heavy Atom Count:14
Complexity:229
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

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