Cas no 21683-86-3 (3-(1-benzofuran-2-yl)propanoic acid)

3-(1-benzofuran-2-yl)propanoic acid structure
21683-86-3 structure
Product Name:3-(1-benzofuran-2-yl)propanoic acid
CAS No:21683-86-3
MF:C11H10O3
MW:190.195303440094
MDL:MFCD07690609
CID:283584
PubChem ID:7131591
Update Time:2025-04-19

3-(1-benzofuran-2-yl)propanoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Benzofuranpropanoicacid
    • 3-(1-BENZOFURAN-2-YL)PROPANOIC ACID
    • 3-(Benzofuran-2-yl)propanoicacid
    • MFCD07690609
    • F8880-0178
    • Z137628830
    • 21683-86-3
    • J-803025
    • AS-62325
    • 3-(Benzofuran-2-yl)propanoic acid
    • W15989
    • SCHEMBL7248298
    • AKOS000119196
    • CHEMBL4218907
    • A911404
    • EN300-15389
    • WAA68386
    • 3-(1-BENZOFURAN-2-YL)PROPANOICACID
    • 3-(1-benzofuran-2-yl)propanoic acid
    • MDL: MFCD07690609
    • Inchi: 1S/C11H10O3/c12-11(13)6-5-9-7-8-3-1-2-4-10(8)14-9/h1-4,7H,5-6H2,(H,12,13)
    • InChI Key: RSCSQNQHINMHDE-UHFFFAOYSA-N
    • SMILES: O1C2C=CC=CC=2C=C1CCC(=O)O

Computed Properties

  • Exact Mass: 189.05517
  • Monoisotopic Mass: 190.062994177g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 215
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 50.4?2

Experimental Properties

  • PSA: 53.27

3-(1-benzofuran-2-yl)propanoic acid Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B428543-10mg
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$ 50.00 2022-06-07
TRC
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$ 160.00 2022-06-07
TRC
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$ 250.00 2022-06-07
abcr
AB317076-250 mg
3-(1-Benzofuran-2-yl)propanoic acid, 95%; .
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€304.00 2023-07-19
abcr
AB317076-1 g
3-(1-Benzofuran-2-yl)propanoic acid, 95%; .
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€544.00 2023-07-19
Chemenu
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Enamine
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Enamine
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