1,4-Methanonaphthalene-1(4H)-carboxylic acid
TL;DR: 1,4-Methanonaphthalene-1(4H)-carboxylic acid (CAS 5890-15-3) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene-1-carboxylic acid
Also Known As: [?]carboxylic acid|benzonorbornadiene-1-carboxylic acid|RCL T214817|1,4-Methanonaphthalene-1(4H)-carboxylic acid|NCI60_016504
| Molecular Formula | C12H10O2 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.06808 |
| Heavy Atoms | 14 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 5890-15-3 |
|---|---|
| SMILES | C1C2C=CC1(C3=CC=CC=C23)C(=O)O |
| InChIKey | MDCSRCMVAGQWEU-UHFFFAOYSA-N |
Product Overview
1,4-Methanonaphthalene-1(4H)-carboxylic acid (CAS 5890-15-3), with molecular formula C12H10O2 and molecular weight 186.07 g/mol. IUPAC: tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraene-1-carboxylic acid.
Chemical Property Profile of 1,4-Methanonaphthalene-1(4H)-carboxylic acid
Property Insights of 1,4-Methanonaphthalene-1(4H)-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Methanonaphthalene-1(4H)-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 1,4-Methanonaphthalene-1(4H)-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Methanonaphthalene-1(4H)-carboxylic 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 1,4-Methanonaphthalene-1(4H)-carboxylic acid?
The CAS number of 1,4-Methanonaphthalene-1(4H)-carboxylic acid is 5890-15-3.
What is the molecular formula of 1,4-Methanonaphthalene-1(4H)-carboxylic acid?
The molecular formula of 1,4-Methanonaphthalene-1(4H)-carboxylic acid is C12H10O2.
What is the molecular weight of 1,4-Methanonaphthalene-1(4H)-carboxylic acid?
The molecular weight of 1,4-Methanonaphthalene-1(4H)-carboxylic acid is 186.07 g/mol.
Where can I buy 1,4-Methanonaphthalene-1(4H)-carboxylic acid?
You can request a quote for 1,4-Methanonaphthalene-1(4H)-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Methanonaphthalene-1(4H)-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Methanonaphthalene-1(4H)-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.