腺碘酮
TL;DR: 腺碘酮 (CAS 606-17-7) is a chemical compound with molecular formula C20H14I6N2O6 and molecular weight 1139.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
腺碘酮
3-[[6-(3-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid
Also Known As: Adipiodone, Iodipamic acid, Cholografin, Cholospect, Bilignostum
| Molecular Formula | C20H14I6N2O6 |
|---|---|
| Molecular Weight | 1139.51 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 1139.512 |
| Heavy Atoms | 34 |
| Complexity | 714.0 |
| Melting Point | 306-308 |
| Solubility | 460 |
| Refractive Index | = 1.3294 at 21.5 °C (c = 0.445 in methanol) |
Chemical Identifiers
| CAS Number | 606-17-7 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1I)NC(=O)CCCCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I |
| InChIKey | FFINMCNLQNTKLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
腺碘酮 (CAS 606-17-7), with molecular formula C20H14I6N2O6 and molecular weight 1139.51 g/mol. IUPAC: 3-[[6-(3-carboxy-2,4,6-triiodoanilino)-6-oxohexanoyl]amino]-2,4,6-triiodobenzoic acid.
Chemical Property Profile of 腺碘酮
Property Insights of 腺碘酮
The XLogP value of 5.5 indicates that Adipiodon is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 腺碘酮. Following Lipinski's Rule of Five, Adipiodon has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adipiodon?
The CAS number of Adipiodon is 606-17-7.
What is the molecular formula of Adipiodon?
The molecular formula of Adipiodon is C20H14I6N2O6.
What is the molecular weight of Adipiodon?
The molecular weight of Adipiodon is 1139.51 g/mol.
Where can I buy Adipiodon?
You can request a quote for Adipiodon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adipiodon?
Yes, KEHONG BIO provides custom synthesis services for Adipiodon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.