Cas no 74855-17-7 (Benzenepentadecanoicacid, 4-(iodo-123I)- (9CI))

Benzenepentadecanoicacid, 4-(iodo-123I)- (9CI) structure
74855-17-7 structure
Product Name:Benzenepentadecanoicacid, 4-(iodo-123I)- (9CI)
CAS No:74855-17-7
MF:C21H33IO2
MW:440.39112830162
CID:570330
PubChem ID:172977
Update Time:2025-04-19

Benzenepentadecanoicacid, 4-(iodo-123I)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Benzenepentadecanoicacid, 4-(iodo-123I)- (9CI)
    • 15-(4-iodanylphenyl)pentadecanoic acid
    • Ioncanlidic
    • Iocanlidic acid (123I) (INN)
    • Benzenepentadecanoic acid,4-(iodo-I)-;
    • Iocanlidic acid I 123
    • CHEMBL3989586
    • D04561
    • Iocanlidic acid I 123 [USAN]
    • IOCANLIDIC ACID [WHO-DD]
    • NS00126817
    • Iocanlidic acid ((sup 123)I)
    • 15-(p-((sup 123)I)Iodophenyl)pentadecanoic acid
    • Q27262125
    • iocanlidic acid ((1)(2)(3)I) [INN]
    • 5GM08MR13W
    • Iocanlidic acid (123I)
    • iocanlidic acid i-123
    • UNII-5GM08MR13W
    • Iocanlidic acid (123I) [INN]
    • I-123-ippa
    • DTXSID90225821
    • Iocanlidic acid I 123 (USAN)
    • IOCANLIDIC ACID, I-123
    • 74855-17-7
    • Benzenepentadecanoic acid, 4-(iodo-(sup 123)I)-
    • 4-IODOPHENYLPENTADECANOIC ACID, I-123
    • (123I)-IODOPHENYLPENTADECANOIC ACID)
    • SCHEMBL1477652
    • Inchi: 1S/C21H33IO2/c22-20-17-15-19(16-18-20)13-11-9-7-5-3-1-2-4-6-8-10-12-14-21(23)24/h15-18H,1-14H2,(H,23,24)/i22-4
    • InChI Key: YAONEUNUMVOKNQ-NHTLRXQVSA-N
    • SMILES: [123I]C1C=CC(=CC=1)CCCCCCCCCCCCCCC(=O)O

Computed Properties

  • Exact Mass: 440.154
  • Monoisotopic Mass: 440.154
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 15
  • Complexity: 298
  • 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: 8.5
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 1.256
  • Refractive Index: 1.537
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