3,5-二碘甲腺丙酸
TL;DR: 3,5-二碘甲腺丙酸 (CAS 13365-47-4) is a chemical compound with molecular formula C15H12I2O4 and molecular weight 509.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二碘甲腺丙酸
3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoic acid
Also Known As: 3,5-Diiodothyropropionic acid, DITPA, Dipro, 3,5-Ditpa, DITPA cpd
| Molecular Formula | C15H12I2O4 |
|---|---|
| Molecular Weight | 509.88 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 509.8825 |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 13365-47-4 |
|---|---|
| SMILES | C1=CC(=CC=C1O)OC2=C(C=C(C=C2I)CCC(=O)O)I |
| InChIKey | WONYMNWUJVKVII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二碘甲腺丙酸 (CAS 13365-47-4), with molecular formula C15H12I2O4 and molecular weight 509.88 g/mol. IUPAC: 3-[4-(4-hydroxyphenoxy)-3,5-diiodophenyl]propanoic acid.
Chemical Property Profile of 3,5-二碘甲腺丙酸
Property Insights of 3,5-二碘甲腺丙酸
The XLogP value of 4.2 indicates that 3,5-二碘甲腺丙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-二碘甲腺丙酸. Following Lipinski's Rule of Five, 3,5-二碘甲腺丙酸 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-二碘甲腺丙酸?
The CAS number of 3,5-二碘甲腺丙酸 is 13365-47-4.
What is the molecular formula of 3,5-二碘甲腺丙酸?
The molecular formula of 3,5-二碘甲腺丙酸 is C15H12I2O4.
What is the molecular weight of 3,5-二碘甲腺丙酸?
The molecular weight of 3,5-二碘甲腺丙酸 is 509.88 g/mol.
Where can I buy 3,5-二碘甲腺丙酸?
You can request a quote for 3,5-二碘甲腺丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二碘甲腺丙酸?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二碘甲腺丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.