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4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid structure
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4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid

TL;DR: 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid (CAS 123748-56-1) is a chemical compound with molecular formula C22H35IO2 and molecular weight 454.1693 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

15-(4-iodophenyl)-3-methylpentadecanoic acid

Also Known As: Zemiva, Iodofiltic acid I 123, Iodofiltic acid (123I), BMIPP, Iodofiltic acid I-123

CAS Number
123748-56-1
Molecular Formula
C22H35IO2
Molecular Weight
454.1693 g/mol
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Technical Specifications

Molecular FormulaC22H35IO2
Molecular Weight454.1693 g/mol
XLogP9.1
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds15
Exact Mass454.1693 Da
Heavy Atoms25
Complexity324.0
SMILESCC(CCCCCCCCCCCCC1=CC=C(C=C1)[123I])CC(=O)O
InChIKeyNPCIWINHUDIWAV-NSYCNWAXSA-N

Chemical Property Profile of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid

XLogP
9.1
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
15
Heavy Atoms
25
Complexity
324.0
Exact Mass
454.1693
Monoisotopic Mass
454.1693
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid

The XLogP value of 9.1 indicates that 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid?

The CAS number of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid is 123748-56-1.

What is the molecular formula of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid?

The molecular formula of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid is C22H35IO2.

What is the molecular weight of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid?

The molecular weight of 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid is 454.1693 g/mol.

Where can I buy 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid?

You can request a quote for 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid?

Yes, CoreyChem provides custom synthesis services for 4-(Iodo-123I)-beta-methylbenzenepentadecanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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