1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde
TL;DR: 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde (CAS 876892-41-0) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-methoxyphenyl)methyl]pyrrole-2-carbaldehyde
Also Known As: 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde, 1-(2-Methoxy-benzyl)-1H-pyrrole-2-carbaldehyde, 1-[(2-methoxyphenyl)methyl]pyrrole-2-carbaldehyde, BAS 11881234, Z-0387
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.3575 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 488.18274 |
Chemical Identifiers
| CAS Number | 876892-41-0 |
|---|---|
| SMILES | COC1=CC=CC=C1CN2C=CC=C2C=O |
Product Overview
1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde (CAS 876892-41-0), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 1-[(2-methoxyphenyl)methyl]pyrrole-2-carbaldehyde.
Chemical Property Profile of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde
Property Insights of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde
The XLogP value of 2.3575 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde. With a topological polar surface area (TPSA) of 31.23 Ų, 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde has 0 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 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde is 876892-41-0.
What is the molecular formula of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde is C13H13NO2.
What is the molecular weight of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde is 215.09 g/mol.
Where can I buy 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-(2-Methoxybenzyl)-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-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methoxybenzyl)-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.