Cas no 72130-68-8 (Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate)

Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate is a heterocyclic compound featuring an indolizine core with a hydroxyl group at the 7-position and a keto functionality at the 5-position. The ethyl ester moiety at the 8-position enhances its solubility in organic solvents, facilitating further synthetic modifications. This structure is of interest in medicinal chemistry due to its potential as a scaffold for bioactive molecules, particularly in the development of anti-inflammatory and antimicrobial agents. Its rigid polycyclic framework offers stability, while the functional groups provide sites for selective derivatization. The compound’s synthetic versatility makes it valuable for exploratory research in pharmaceutical and agrochemical applications.
Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate structure
72130-68-8 structure
Product Name:Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
CAS No:72130-68-8
MF:C11H13NO4
MW:223.225223302841
CID:59316
PubChem ID:54680554
Update Time:2025-11-02

Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
    • 1,2,3,5-Tetrahydro-7-hydroxy-5-oxo-8-indolizinecarboxylic acid ethyl ester
    • ethyl 7-hydroxy-5-oxo-1,2,3,5-
    • ethyl 7-hydroxy-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylate
    • 7-hydroxy-5-oxo-1,2,3,5-tetrahydro-indolizine-8-carboxylic acid ethyl ester
    • 7-Hydroxy-8-(ethoxycarbonyl)-2,3-dihydro-1H-indolizin-5-one
    • 7-hydroxy-8-methoxycarbonyl-2,3-dihydro-1H-indolizin-5-one
    • Ethyl 5-hydroxy-7-oxo-2,3-dihydro-1H-indolizine-8-carboxylate
    • ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydro-8-indolizinecarboxylate
    • SCHEMBL711780
    • AC-24696
    • AS-76333
    • 7-Hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
    • ZB1363
    • AKOS005724029
    • DTXSID40715686
    • AKOS005063574
    • ethyl7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
    • 72130-68-8
    • NWSKLPDPUFBJDU-UHFFFAOYSA-N
    • CS-0100891
    • FT-0656807
    • DB-029757
    • STL096125
    • ethyl 5-hydroxy-7-oxo-1,2,3,7-tetrahydroindolizine-8-carboxylate
    • ETHYL 7-HYDROXY-5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE -8-CARBOXYLATE
    • MDL: MFCD03085738
    • Inchi: 1S/C11H13NO4/c1-2-16-11(15)10-7-4-3-5-12(7)9(14)6-8(10)13/h6,13H,2-5H2,1H3
    • InChI Key: NWSKLPDPUFBJDU-UHFFFAOYSA-N
    • SMILES: O=C1C=C(C(C(=O)OCC)=C2CCCN21)O

Computed Properties

  • Exact Mass: 223.08400
  • Monoisotopic Mass: 223.08445790g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 408
  • 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: 0.6
  • Topological Polar Surface Area: 66.8?2

Experimental Properties

  • Density: 1.36
  • Boiling Point: 368.872 °C at 760 mmHg
  • Flash Point: 368.872 °C at 760 mmHg
  • Refractive Index: 1.593
  • PSA: 68.53000
  • LogP: 0.67680

Ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate 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%

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