1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde
TL;DR: 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde (CAS 37560-49-9) is a chemical compound with molecular formula C13H13NO and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethylphenyl)pyrrole-2-carbaldehyde
Also Known As: 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde, 1-(3,5-dimethylphenyl)pyrrole-2-carbaldehyde, 1- -1H-PYRROLE-2-CARBALDEHYDE, BB 0249252, K-8281
| Molecular Formula | C13H13NO |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 2.90664 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.09972 |
| Heavy Atoms | 15 |
| Complexity | 476.7371 |
Chemical Identifiers
| CAS Number | 37560-49-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C=CC=C2C=O)C |
Product Overview
1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde (CAS 37560-49-9), with molecular formula C13H13NO and molecular weight 199.10 g/mol. IUPAC: 1-(3,5-dimethylphenyl)pyrrole-2-carbaldehyde.
Chemical Property Profile of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde
Property Insights of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde
The XLogP value of 2.90664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde. With a topological polar surface area (TPSA) of 22.0 Ų, 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-dimethylphenyl)-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-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde is 37560-49-9.
What is the molecular formula of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde is C13H13NO.
What is the molecular weight of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde is 199.10 g/mol.
Where can I buy 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-(3,5-dimethylphenyl)-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-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-dimethylphenyl)-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.