Cas no 4443-68-9 (1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI))

1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI) structure
4443-68-9 structure
Product Name:1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI)
CAS No:4443-68-9
MF:C10H16N2O3S
MW:244.310641288757
CID:333196
Update Time:2024-01-28

1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1H-Thieno[3,4-d]imidazole-4-pentanoicacid, hexahydro-2-oxo- (9CI)
    • Biotin
    • d-biotin
    • dl-biotin
    • hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic acid
    • racem. Biotin
    • Inchi: 1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)
    • InChI Key: YBJHBAHKTGYVGT-UHFFFAOYSA-N
    • SMILES: C1(=O)NC2C(CCCCC(O)=O)SCC2N1

Computed Properties

  • Exact Mass: 244.08800

Experimental Properties

  • Density: 1.267±0.06 g/cm3(Predicted)
  • Boiling Point: 573.6±35.0 °C(Predicted)
  • PSA: 103.73000
  • LogP: 1.45440
  • pka: 4.74±0.10(Predicted)
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