3,4-Dimethyl-2,5-pyrroledicarboxaldehyde
TL;DR: 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde (CAS 51952-99-9) is a chemical compound with molecular formula C8H9NO2 and molecular weight 151.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethyl-1H-pyrrole-2,5-dicarbaldehyde
Also Known As: 3,4-dimethyl-1H-pyrrole-2,5-dicarbaldehyde, 3,4-dimethyl-2,5-pyrroledicarboxaldehyde, 2,5-diformyl-3,4-dimethyl-1h-pyrrole, 3,4-Dimethyl-1H-pyrrole-2,5-dicarboxaldehyde, 1H-Pyrrole-2,5-dicarboxaldehyde, 3,4-dimethyl- (9CI)
| Molecular Formula | C8H9NO2 |
|---|---|
| Molecular Weight | 151.06 g/mol |
| LogP | 1.25654 |
| Topological Polar Surface Area | 49.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 151.06332 |
| Heavy Atoms | 11 |
| Complexity | 270.78586 |
Chemical Identifiers
| CAS Number | 51952-99-9 |
|---|---|
| SMILES | CC1=C(NC(=C1C)C=O)C=O |
Product Overview
3,4-Dimethyl-2,5-pyrroledicarboxaldehyde (CAS 51952-99-9), with molecular formula C8H9NO2 and molecular weight 151.06 g/mol. IUPAC: 3,4-dimethyl-1H-pyrrole-2,5-dicarbaldehyde.
Chemical Property Profile of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde
Property Insights of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde
The XLogP value of 1.25654 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde. With a topological polar surface area (TPSA) of 49.93 Ų, 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde 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 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde?
The CAS number of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde is 51952-99-9.
What is the molecular formula of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde?
The molecular formula of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde is C8H9NO2.
What is the molecular weight of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde?
The molecular weight of 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde is 151.06 g/mol.
Where can I buy 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde?
You can request a quote for 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dimethyl-2,5-pyrroledicarboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.