Cas no 123748-56-1 (Benzenepentadecanoicacid, 4-(iodo-123I)-b-methyl-)

Benzenepentadecanoicacid, 4-(iodo-123I)-b-methyl- structure
123748-56-1 structure
Product Name:Benzenepentadecanoicacid, 4-(iodo-123I)-b-methyl-
CAS No:123748-56-1
MF:C22H35IO2
MW:454.41770863533
CID:170675
PubChem ID:636427
Update Time:2025-04-19

Benzenepentadecanoicacid, 4-(iodo-123I)-b-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzenepentadecanoicacid, 4-(iodo-123I)-b-methyl-
    • 15-(4-iodanylphenyl)-3-methylpentadecanoic acid
    • AC1LCS7E
    • I-123 BMIPP
    • Iodofiltic acid I 123
    • Iodofiltic acid I 123 [USAN:INN]
    • UNII-0J7USQ749M
    • Zemiva
    • Zemiva (TN)
    • 15-[4-(~123~I)iodophenyl]-3-Methylpentadecanoic acid
    • CHEBI:31683
    • Iodofiltic acid I 123 (USAN/INN)
    • BENZENEPENTADECANOIC ACID, 4-(IODO-(SUP 123)I)-.BETA.-METHYL-
    • 123I-15-(p-iodophenyl)-3-R,S-methylpentadecanoic acid
    • 15-(4-iodanylphenyl)-3-methyl-pentadecanoic acid
    • IODOFILTIC ACID I 123 [USAN]
    • DTXSID60924591
    • I-123-beta-methyl-p-iodophenyl-methylpentadecanoic acid
    • 123748-56-1
    • DB05683
    • D06608
    • 15-(p-Iodophenyl)-3-methylpentadecanoic acid (123I)
    • iodofiltic acid ((1)(2)(3)I) [INN]
    • 0J7USQ749M
    • Q27114658
    • BMIP-P I-123
    • (3RS)-15-(4-((SUP 123)I)IODOPHENYL)-3-METHYLPENTADECANOIC ACID
    • 15-(4-Iodophenyl)-3(R,S)-methylpentadecanoic acid (123I)
    • Iodofiltic acid (123I) [INN]
    • Iodofiltic acid I-123
    • Iodofiltic acid (123I)
    • BMIPP I-123
    • 123i-bmipp
    • 15-(4-(123I)iodanylphenyl)-3-methylpentadecanoic acid
    • BMIPP
    • CHEMBL3989901
    • Cardiodine
    • Inchi： 1S/C22H35IO2/c1-19(18-22(24)25)12-10-8-6-4-2-3-5-7-9-11-13-20-14-16-21(23)17-15-20/h14-17,19H,2-13,18H2,1H3,(H,24,25)/i23-4
    • InChI Key： NPCIWINHUDIWAV-NSYCNWAXSA-N
    • SMILES： [123I]C1C=CC(=CC=1)CCCCCCCCCCCCC(C)CC(=O)O

Computed Properties

  • Exact Mass: 331.26385
  • Monoisotopic Mass: 454.169
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 15
  • Complexity: 324
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 9.1
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • Density: 1.237
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • Refractive Index: 1.533
  • PSA: 37.3

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