1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde
TL;DR: 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde (CAS 37800-98-9) is a chemical compound with molecular formula C11H8ClNO and molecular weight 205.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)pyrrole-2-carbaldehyde
Also Known As: 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde, 1-(4-chlorophenyl)pyrrole-2-carbaldehyde, 2-Pyrrolidin-2-ylpyridine, 1-p-Chlorphenyl-2-pyrrolcarbaldehyd, 1-(4-Chlorophenyl)-1H-pyrrole-2-carboxaldehyde
| Molecular Formula | C11H8ClNO |
|---|---|
| Molecular Weight | 205.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.02943 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 37800-98-9 |
|---|---|
| SMILES | C1=CN(C(=C1)C=O)C2=CC=C(C=C2)Cl |
| InChIKey | NNQOVJLQFYROBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde (CAS 37800-98-9), with molecular formula C11H8ClNO and molecular weight 205.03 g/mol. IUPAC: 1-(4-chlorophenyl)pyrrole-2-carbaldehyde.
Chemical Property Profile of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde
Property Insights of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde. With a topological polar surface area (TPSA) of 22.0 Ų, 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde has 0 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 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde is 37800-98-9.
What is the molecular formula of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde is C11H8ClNO.
What is the molecular weight of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde is 205.03 g/mol.
Where can I buy 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chlorophenyl)-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.