2,5-Dimethyl-1-phenylpyrrole
TL;DR: 2,5-Dimethyl-1-phenylpyrrole (CAS 83-24-9) is a chemical compound with molecular formula C12H13N and molecular weight 171.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-1-phenylpyrrole
Also Known As: 2,5-Dimethyl-1-phenylpyrrole, 2,5-Dimethyl-1-phenyl-1H-pyrrole, 1-Phenyl-2,5-dimethylpyrrole, 1H-Pyrrole, 2,5-dimethyl-1-phenyl-, Pyrrole, 2,5-dimethyl-1-phenyl-
| Molecular Formula | C12H13N |
|---|---|
| Molecular Weight | 171.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 4.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.1048 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 83-24-9 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC=CC=C2)C |
| InChIKey | JNXIFVSGXLGULI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dimethyl-1-phenylpyrrole (CAS 83-24-9), with molecular formula C12H13N and molecular weight 171.10 g/mol. IUPAC: 2,5-dimethyl-1-phenylpyrrole.
Chemical Property Profile of 2,5-Dimethyl-1-phenylpyrrole
Property Insights of 2,5-Dimethyl-1-phenylpyrrole
The XLogP value of 3.1 indicates that 2,5-Dimethyl-1-phenylpyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.9 Ų, 2,5-Dimethyl-1-phenylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-1-phenylpyrrole has 0 hydrogen bond donor(s) and 0 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 2,5-Dimethyl-1-phenylpyrrole?
The CAS number of 2,5-Dimethyl-1-phenylpyrrole is 83-24-9.
What is the molecular formula of 2,5-Dimethyl-1-phenylpyrrole?
The molecular formula of 2,5-Dimethyl-1-phenylpyrrole is C12H13N.
What is the molecular weight of 2,5-Dimethyl-1-phenylpyrrole?
The molecular weight of 2,5-Dimethyl-1-phenylpyrrole is 171.10 g/mol.
Where can I buy 2,5-Dimethyl-1-phenylpyrrole?
You can request a quote for 2,5-Dimethyl-1-phenylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-1-phenylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-1-phenylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.