Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate
TL;DR: Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate (CAS 3604-36-2) is a chemical compound with molecular formula C9H10O2 and molecular weight 150.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl bicyclo[2.2.1]hepta-2,5-diene-2-carboxylate
Also Known As: Methyl bicyclo(2.2.1)hepta-2,5-dienecarboxylate, Methyl bicyclo[2.2.1]hepta-2,5-diene carboxylate, Norborna-2,5-diene-2-carboxylic acid methyl ester, methyl bicyclo[2.2.1]hepta-2,5-diene-2-carboxylate, 2-methyloxycarbonyl-bicyclo[2.2.1]hepta-2,5-diene
| Molecular Formula | C9H10O2 |
|---|---|
| Molecular Weight | 150.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 150.06808 |
| Heavy Atoms | 11 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 3604-36-2 |
|---|---|
| SMILES | COC(=O)C1=CC2CC1C=C2 |
| InChIKey | ABYXLSPPPNXLTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate (CAS 3604-36-2), with molecular formula C9H10O2 and molecular weight 150.07 g/mol. IUPAC: methyl bicyclo[2.2.1]hepta-2,5-diene-2-carboxylate.
Chemical Property Profile of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate
Property Insights of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate has 0 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 Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate?
The CAS number of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate is 3604-36-2.
What is the molecular formula of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate?
The molecular formula of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate is C9H10O2.
What is the molecular weight of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate?
The molecular weight of Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate is 150.07 g/mol.
Where can I buy Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate?
You can request a quote for Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl bicyclo(2.2.1)hepta-2,5-diene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.