3-(2-碘苯基)丙-2-烯酸
TL;DR: 3-(2-碘苯基)丙-2-烯酸 (CAS 90276-19-0) is a chemical compound with molecular formula C9H7IO2 and molecular weight 273.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-碘苯基)丙-2-烯酸
3-(2-iodophenyl)prop-2-enoic acid
Also Known As: 2-Iodocinnamic acid, (2E)-3-(2-iodophenyl)prop-2-enoic acid, 3-(2-Iodophenyl)-2-propenoic acid, 3-(2-iodophenyl)prop-2-enoic acid, (2E)-3-(2-Iodophenyl)acrylic acid
| Molecular Formula | C9H7IO2 |
|---|---|
| Molecular Weight | 273.95 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.94907 |
| Heavy Atoms | 12 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 90276-19-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC(=O)O)I |
| InChIKey | SBCFNNJYIXFMFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-碘苯基)丙-2-烯酸 (CAS 90276-19-0), with molecular formula C9H7IO2 and molecular weight 273.95 g/mol. IUPAC: 3-(2-iodophenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(2-碘苯基)丙-2-烯酸
Property Insights of 3-(2-碘苯基)丙-2-烯酸
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-碘苯基)丙-2-烯酸. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(2-碘苯基)丙-2-烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-碘苯基)丙-2-烯酸 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2-碘苯基)丙-2-烯酸?
The CAS number of 3-(2-碘苯基)丙-2-烯酸 is 90276-19-0.
What is the molecular formula of 3-(2-碘苯基)丙-2-烯酸?
The molecular formula of 3-(2-碘苯基)丙-2-烯酸 is C9H7IO2.
What is the molecular weight of 3-(2-碘苯基)丙-2-烯酸?
The molecular weight of 3-(2-碘苯基)丙-2-烯酸 is 273.95 g/mol.
Where can I buy 3-(2-碘苯基)丙-2-烯酸?
You can request a quote for 3-(2-碘苯基)丙-2-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-碘苯基)丙-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-碘苯基)丙-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.