1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde
TL;DR: 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde (CAS 260802-64-0) is a chemical compound with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methyl-2-nitrophenyl)pyrrole-2-carbaldehyde
Also Known As: 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde, 1-(4-methyl-2-nitrophenyl)pyrrole-2-carbaldehyde, 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carboxaldehyde, 1H-PYRROLE-2-CARBOXALDEHYDE,1-(4-METHYL-2-NITROPHENYL)-
| Molecular Formula | C12H10N2O3 |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 2.50642 |
| Topological Polar Surface Area | 65.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.06914 |
| Heavy Atoms | 17 |
| Complexity | 587.1867 |
Chemical Identifiers
| CAS Number | 260802-64-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C=CC=C2C=O)[N+](=O)[O-] |
Product Overview
1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde (CAS 260802-64-0), with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol. IUPAC: 1-(4-methyl-2-nitrophenyl)pyrrole-2-carbaldehyde.
Chemical Property Profile of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde
Property Insights of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde
The XLogP value of 2.50642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde. Following Lipinski's Rule of Five, 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde has 0 hydrogen bond donor(s) and 3 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-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde is 260802-64-0.
What is the molecular formula of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde is C12H10N2O3.
What is the molecular weight of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde is 230.07 g/mol.
Where can I buy 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-(4-methyl-2-nitrophenyl)-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-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methyl-2-nitrophenyl)-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.