Cas no 76208-99-6 (3-(propionylamino)benzoic Acid)

3-(propionylamino)benzoic Acid structure
76208-99-6 structure
Product Name:3-(propionylamino)benzoic Acid
CAS No:76208-99-6
MF:C10H11NO3
MW:193.199242830276
MDL:MFCD03604396
CID:561106
PubChem ID:4777953
Update Time:2025-04-19

3-(propionylamino)benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 3-Propionamidobenzoic acid
    • 3-(Propionylamino)benzoic acid
    • Benzoic acid,3-[(1-oxopropyl)amino]-
    • 3-propanamidobenzoic acid
    • AC1NGPEV
    • AC1Q2RS5
    • CTK6C6732
    • MolPort-004-311-818
    • MFCD03604396
    • CS-0249765
    • FT-0683653
    • Z85877498
    • 3-Propionamidobenzoicacid
    • AKOS000104720
    • VS-00590
    • EN300-45129
    • 3-(propanoylamino)benzoic Acid
    • DTXSID90406476
    • SCHEMBL10964661
    • 76208-99-6
    • 3-(propionylamino)benzoic Acid
    • MDL： MFCD03604396
    • Inchi： 1S/C10H11NO3/c1-2-9(12)11-8-5-3-4-7(6-8)10(13)14/h3-6H,2H2,1H3,(H,11,12)(H,13,14)
    • InChI Key： YTGHXTTUKCSBJM-UHFFFAOYSA-N
    • SMILES： O=C(CC)NC1C=CC=C(C(=O)O)C=1

Computed Properties

  • Exact Mass: 193.07393
  • Monoisotopic Mass: 193.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 227
  • 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: 1.8
  • Topological Polar Surface Area: 66.4?2

Experimental Properties

  • Density: 1.274
  • Boiling Point: 444.2°C at 760 mmHg
  • Flash Point: 222.5°C
  • Refractive Index: 1.603
  • PSA: 66.4

3-(propionylamino)benzoic Acid Security Information

  • HazardClass：IRRITANT

3-(propionylamino)benzoic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Matrix Scientific
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Alichem
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Enamine
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Enamine
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Enamine
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Enamine
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