Cas no 54474-50-9 (3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid)

3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid structure
54474-50-9 structure
Product Name:3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid
CAS No:54474-50-9
MF:C9H13NO2
MW:167.205022573471
MDL:MFCD02684431
CID:366588
PubChem ID:1512519
Update Time:2025-04-19

3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid Chemical and Physical Properties

Names and Identifiers

    • 3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic acid
    • 1H-Pyrrole-3-propanoicacid, 2,4-dimethyl-
    • 2,4-DIMETHYL-3-PYRROLEPROPIONIC ACID
    • 2,4-DIMETHYL-3-PYRROLEPROPANOIC ACID
    • RW3906
    • SAGABBLUUSFKNW-UHFFFAOYSA
    • SAGABBLUUSFKNW-UHFFFAOYSA-
    • SAGABBLUUSFKNW-UHFFFAOYSA-N
    • 2,4-dimethyl-3-carboxyethylpyrrole
    • FCH919917
    • 3-(2-carboxyethyl)-2,4-dimethylpyrrole
    • 2,4-Dimethyl-1H-pyrrole-3-propionic acid
    • 2,4-Dimethyl-1H-pyrrole-3-propanoic acid
    • AX8067066
    • ST24041376
    • EN300-1845197
    • 3-(2,4-dimethyl-1H-pyrrol-3-yl)-propionic acid
    • 3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoicacid
    • 2,4-DIMETHYL-3-PYRROLEPROPIONICACID
    • DTXSID80363701
    • S11305
    • SCHEMBL1981904
    • MFCD02684431
    • InChI=1/C9H13NO2/c1-6-5-10-7(2)8(6)3-4-9(11)12/h5,10H,3-4H2,1-2H3,(H,11,12)
    • A870439
    • AKOS006237665
    • CS-W001847
    • 54474-50-9
    • 3-(2 pound not4-Dimethyl-1H-pyrrol-3-yl)propanoic acid
    • DS-12702
    • FT-0600137
    • SB62016
    • 3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid
    • MDL： MFCD02684431
    • Inchi： 1S/C9H13NO2/c1-6-5-10-7(2)8(6)3-4-9(11)12/h5,10H,3-4H2,1-2H3,(H,11,12)
    • InChI Key： SAGABBLUUSFKNW-UHFFFAOYSA-N
    • SMILES： OC(CCC1C(C)=CNC=1C)=O

Computed Properties

  • Exact Mass: 167.09500
  • Monoisotopic Mass: 167.095
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 170
  • 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
  • Topological Polar Surface Area: 53.1
  • XLogP3: 1.2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.2±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 332.8°C at 760 mmHg
  • Flash Point: 155.1±26.5 °C
  • Refractive Index: 1.551
  • PSA: 53.09000
  • LogP: 1.64870

3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid Security Information

3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-(2,4-Dimethyl-1H-pyrrol-3-yl)propanoic Acid Pricemore >>

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