3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid
TL;DR: 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid (CAS 7498-69-3) is a chemical compound with molecular formula C13H14O2 and molecular weight 202.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enoic acid
Also Known As: 3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enoic acid, (E)-3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enoic acid
| Molecular Formula | C13H14O2 |
|---|---|
| Molecular Weight | 202.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.09938 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 7498-69-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)C=CC(=O)O |
| InChIKey | YUQNQGDQNKUERN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid (CAS 7498-69-3), with molecular formula C13H14O2 and molecular weight 202.10 g/mol. IUPAC: 3-(5,6,7,8-tetrahydronaphthalen-2-yl)prop-2-enoic acid.
Chemical Property Profile of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid
Property Insights of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid
The XLogP value of 3.3 indicates that 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic 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, 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid 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-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid?
The CAS number of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid is 7498-69-3.
What is the molecular formula of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid?
The molecular formula of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid is C13H14O2.
What is the molecular weight of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid?
The molecular weight of 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid is 202.10 g/mol.
Where can I buy 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid?
You can request a quote for 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5,6,7,8-Tetrahydronaphthalen-2-yl)prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.