1H-Pyrrole, 1-(1-methylethyl)-
TL;DR: 1H-Pyrrole, 1-(1-methylethyl)- (CAS 7057-97-8) is a chemical compound with molecular formula C7H11N and molecular weight 109.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-ylpyrrole
Also Known As: 1-isopropylpyrrole, N-Isopropylpyrrol, 1-propan-2-ylpyrrole, 1-Isopropyl-1H-pyrrole, 1H-Pyrrole, 1-(1-methylethyl)-
| Molecular Formula | C7H11N |
|---|---|
| Molecular Weight | 109.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 4.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 109.08915 |
| Heavy Atoms | 8 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 7057-97-8 |
|---|---|
| SMILES | CC(C)N1C=CC=C1 |
| InChIKey | KNDUGOWIKQAXHL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrrole, 1-(1-methylethyl)- (CAS 7057-97-8), with molecular formula C7H11N and molecular weight 109.09 g/mol. IUPAC: 1-propan-2-ylpyrrole.
Chemical Property Profile of 1H-Pyrrole, 1-(1-methylethyl)-
Property Insights of 1H-Pyrrole, 1-(1-methylethyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole, 1-(1-methylethyl)-. With a topological polar surface area (TPSA) of 4.9 Ų, 1H-Pyrrole, 1-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole, 1-(1-methylethyl)- 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 1H-Pyrrole, 1-(1-methylethyl)-?
The CAS number of 1H-Pyrrole, 1-(1-methylethyl)- is 7057-97-8.
What is the molecular formula of 1H-Pyrrole, 1-(1-methylethyl)-?
The molecular formula of 1H-Pyrrole, 1-(1-methylethyl)- is C7H11N.
What is the molecular weight of 1H-Pyrrole, 1-(1-methylethyl)-?
The molecular weight of 1H-Pyrrole, 1-(1-methylethyl)- is 109.09 g/mol.
Where can I buy 1H-Pyrrole, 1-(1-methylethyl)-?
You can request a quote for 1H-Pyrrole, 1-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole, 1-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole, 1-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.