3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde
TL;DR: 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde (CAS 38997-06-7) is a chemical compound with molecular formula C6H5Br2NO and molecular weight 264.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dibromo-5-methyl-1H-pyrrole-2-carbaldehyde
Also Known As: 3,4-dibromo-5-methyl-1H-pyrrole-2-carbaldehyde, 3,4-dibromo-5-methyl-2-pyrrolecarboxaldehyde, 668-693-8, RefChem:485852
| Molecular Formula | C6H5Br2NO |
|---|---|
| Molecular Weight | 264.87 g/mol |
| LogP | 2.66062 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.87378 |
| Heavy Atoms | 10 |
| Complexity | 266.9567 |
Chemical Identifiers
| CAS Number | 38997-06-7 |
|---|---|
| SMILES | CC1=C(C(=C(N1)C=O)Br)Br |
Product Overview
3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde (CAS 38997-06-7), with molecular formula C6H5Br2NO and molecular weight 264.87 g/mol. IUPAC: 3,4-dibromo-5-methyl-1H-pyrrole-2-carbaldehyde.
Chemical Property Profile of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde
Property Insights of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde
The XLogP value of 2.66062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde. With a topological polar surface area (TPSA) of 32.86 Ų, 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde has 1 hydrogen bond donor(s) and 1 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-Dibromo-5-methyl-2-pyrrolecarboxaldehyde?
The CAS number of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde is 38997-06-7.
What is the molecular formula of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde?
The molecular formula of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde is C6H5Br2NO.
What is the molecular weight of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde?
The molecular weight of 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde is 264.87 g/mol.
Where can I buy 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde?
You can request a quote for 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dibromo-5-methyl-2-pyrrolecarboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.