2-Heptyl-1H-pyrrole
TL;DR: 2-Heptyl-1H-pyrrole (CAS 878-12-6) is a chemical compound with molecular formula C11H19N and molecular weight 165.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-heptyl-1H-pyrrole
Also Known As: 2-heptyl-1H-pyrrole, 2-heptylpyrrole, RefChem:261384
| Molecular Formula | C11H19N |
|---|---|
| Molecular Weight | 165.15 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 165.15175 |
| Heavy Atoms | 12 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 878-12-6 |
|---|---|
| SMILES | CCCCCCCC1=CC=CN1 |
| InChIKey | LWKKQSGNDZXJEO-UHFFFAOYSA-N |
Product Overview
2-Heptyl-1H-pyrrole (CAS 878-12-6), with molecular formula C11H19N and molecular weight 165.15 g/mol. IUPAC: 2-heptyl-1H-pyrrole.
Chemical Property Profile of 2-Heptyl-1H-pyrrole
Property Insights of 2-Heptyl-1H-pyrrole
The XLogP value of 5.5 indicates that 2-Heptyl-1H-pyrrole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.8 Ų, 2-Heptyl-1H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptyl-1H-pyrrole has 1 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Heptyl-1H-pyrrole?
The CAS number of 2-Heptyl-1H-pyrrole is 878-12-6.
What is the molecular formula of 2-Heptyl-1H-pyrrole?
The molecular formula of 2-Heptyl-1H-pyrrole is C11H19N.
What is the molecular weight of 2-Heptyl-1H-pyrrole?
The molecular weight of 2-Heptyl-1H-pyrrole is 165.15 g/mol.
Where can I buy 2-Heptyl-1H-pyrrole?
You can request a quote for 2-Heptyl-1H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptyl-1H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptyl-1H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.