Cas no 890098-01-8 ( )

  structure
  structure
Product Name: 
CAS No:890098-01-8
MF:C11H16O2S
MW:212.308542251587
MDL:MFCD07698779
CID:880338
PubChem ID:24722731
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-(3-thienyl)pentanoate
    • ethyl 5-thiophen-3-ylpentanoate
    • 890098-01-8
    • DTXSID30641425
    • ETHYL5-(3-THIENYL)PENTANOATE
    • MFCD07698779
    • AKOS016017733
    • ETHYL 5-(THIOPHEN-3-YL)PENTANOATE
    • MFCD26958740
    •  
    • MDL: MFCD07698779
    • Inchi: 1S/C11H16O2S/c1-2-13-11(12)6-4-3-5-10-7-8-14-9-10/h7-9H,2-6H2,1H3
    • InChI Key: LBLVHVWHQUZFJO-UHFFFAOYSA-N
    • SMILES: S1C=CC(=C1)CCCCC(=O)OCC

Computed Properties

  • Exact Mass: 212.08700
  • Monoisotopic Mass: 212.08710092g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 7
  • Complexity: 171
  • 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: 3
  • Topological Polar Surface Area: 54.5?2

Experimental Properties

  • PSA: 54.54000
  • LogP: 3.02400

  Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. 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

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

  Pricemore >>

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