Cas no 101336-01-0 (2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt)

2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt structure
101336-01-0 structure
Product Name:2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt
CAS No:101336-01-0
MF:C18H23NaO2S
MW:326.428795099258
CID:1128753
Update Time:2024-07-27

2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt
    • 2-Thiophenepentanoic acid, 5-(3-phenylpropyl)-, sodium salt (1:1)
    • Inchi: 1S/C18H22O2S.Na.H/c19-18(20)12-5-4-10-16-13-14-17(21-16)11-6-9-15-7-2-1-3-8-15;;/h1-3,7-8,13-14H,4-6,9-12H2,(H,19,20);;
    • InChI Key: FMKXLLBVPUMHII-UHFFFAOYSA-N
    • SMILES: C(C1=CC=C(CCCCC(=O)O)S1)CCC1C=CC=CC=1.[NaH]

Computed Properties

  • Exact Mass: 324.11613

Experimental Properties

  • PSA: 40.13

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