4,5-二溴-2-吡咯甲酸
TL;DR: 4,5-二溴-2-吡咯甲酸 (CAS 7369-51-9) is a chemical compound with molecular formula C5H3Br2NO2 and molecular weight 266.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-二溴-2-吡咯甲酸
4,5-dibromo-1H-pyrrole-2-carboxylic acid
Also Known As: 4,5-dibromo-1H-pyrrole-2-carboxylic acid, DBPA, 4,5-Dibromo-2-pyrrolic acid, bis(benzyl)phosphinic acid, dibromopyrrolecarboxylicacid
| Molecular Formula | C5H3Br2NO2 |
|---|---|
| Molecular Weight | 266.85 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.85306 |
| Heavy Atoms | 10 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 7369-51-9 |
|---|---|
| SMILES | C1=C(NC(=C1Br)Br)C(=O)O |
| InChIKey | ZUROCNHARMFRKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-二溴-2-吡咯甲酸 (CAS 7369-51-9), with molecular formula C5H3Br2NO2 and molecular weight 266.85 g/mol. IUPAC: 4,5-dibromo-1H-pyrrole-2-carboxylic acid.
Chemical Property Profile of 4,5-二溴-2-吡咯甲酸
Property Insights of 4,5-二溴-2-吡咯甲酸
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-二溴-2-吡咯甲酸. With a topological polar surface area (TPSA) of 53.1 Ų, 4,5-二溴-2-吡咯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-二溴-2-吡咯甲酸 has 2 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 4,5-二溴-2-吡咯甲酸?
The CAS number of 4,5-二溴-2-吡咯甲酸 is 7369-51-9.
What is the molecular formula of 4,5-二溴-2-吡咯甲酸?
The molecular formula of 4,5-二溴-2-吡咯甲酸 is C5H3Br2NO2.
What is the molecular weight of 4,5-二溴-2-吡咯甲酸?
The molecular weight of 4,5-二溴-2-吡咯甲酸 is 266.85 g/mol.
Where can I buy 4,5-二溴-2-吡咯甲酸?
You can request a quote for 4,5-二溴-2-吡咯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-二溴-2-吡咯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4,5-二溴-2-吡咯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.