1-Methyl-2,5-dichloro-3,4-diformylpyrrole
TL;DR: 1-Methyl-2,5-dichloro-3,4-diformylpyrrole (CAS 42095-94-3) is a chemical compound with molecular formula C7H5Cl2NO2 and molecular weight 204.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dichloro-1-methylpyrrole-3,4-dicarbaldehyde
Also Known As: 1-methyl-2,5-dichloro-3,4-diformylpyrrole, 2,5-dichloro-1-methyl-1H-pyrrole-3,4-dicarbaldehyde, BB 0221268, 2,5-dichloro-1-methylpyrrole-3,4-dicarbaldehyde, 2,5-dichloro-1-methyl-pyrrole-3,4-dicarbaldehyde
| Molecular Formula | C7H5Cl2NO2 |
|---|---|
| Molecular Weight | 204.97 g/mol |
| LogP | 1.9569 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.96973 |
| Heavy Atoms | 12 |
| Complexity | 312.16583 |
Chemical Identifiers
| CAS Number | 42095-94-3 |
|---|---|
| SMILES | CN1C(=C(C(=C1Cl)C=O)C=O)Cl |
Product Overview
1-Methyl-2,5-dichloro-3,4-diformylpyrrole (CAS 42095-94-3), with molecular formula C7H5Cl2NO2 and molecular weight 204.97 g/mol. IUPAC: 2,5-dichloro-1-methylpyrrole-3,4-dicarbaldehyde.
Chemical Property Profile of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole
Property Insights of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole
The XLogP value of 1.9569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-2,5-dichloro-3,4-diformylpyrrole. With a topological polar surface area (TPSA) of 39.07 Ų, 1-Methyl-2,5-dichloro-3,4-diformylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-2,5-dichloro-3,4-diformylpyrrole 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 1-Methyl-2,5-dichloro-3,4-diformylpyrrole?
The CAS number of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole is 42095-94-3.
What is the molecular formula of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole?
The molecular formula of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole is C7H5Cl2NO2.
What is the molecular weight of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole?
The molecular weight of 1-Methyl-2,5-dichloro-3,4-diformylpyrrole is 204.97 g/mol.
Where can I buy 1-Methyl-2,5-dichloro-3,4-diformylpyrrole?
You can request a quote for 1-Methyl-2,5-dichloro-3,4-diformylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2,5-dichloro-3,4-diformylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2,5-dichloro-3,4-diformylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.