Methylhimic acid
TL;DR: Methylhimic acid (CAS 28871-71-8) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Methylhimic acid
2-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
Also Known As: methylhimic acid, 2-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 3-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, RefChem:357012
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 28871-71-8 |
|---|---|
| SMILES | CC1(C2CC(C1C(=O)O)C=C2)C(=O)O |
| InChIKey | OJVQNVMHJWSOSY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methylhimic acid (CAS 28871-71-8), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: 2-methylbicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid.
Chemical Property Profile of Methylhimic acid
Property Insights of Methylhimic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methylhimic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylhimic acid. Following Lipinski's Rule of Five, Methylhimic acid has 2 hydrogen bond donor(s) and 4 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 Methylhimic acid?
The CAS number of Methylhimic acid is 28871-71-8.
What is the molecular formula of Methylhimic acid?
The molecular formula of Methylhimic acid is C10H12O4.
What is the molecular weight of Methylhimic acid?
The molecular weight of Methylhimic acid is 196.07 g/mol.
Where can I buy Methylhimic acid?
You can request a quote for Methylhimic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylhimic acid?
Yes, KEHONG BIO provides custom synthesis services for Methylhimic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.