(1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone
TL;DR: (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone (CAS 121806-03-9) 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-methylpyrrol-2-yl)-(3-nitrophenyl)methanone
Also Known As: 2-(3-nitrobenzoyl)-1-methylpyrrole, (1-methylpyrrol-2-yl)-(3-nitrophenyl)methanone, 1-Methyl-2-(3-nitrobenzoyl)-1H-pyrrole, J3.007.259F, (1-Methyl-1H-pyrrol-2-yl)(3-nitrophenyl)methanone
| Molecular Formula | C12H10N2O3 |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 2.1643 |
| 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 | 586.9416 |
Chemical Identifiers
| CAS Number | 121806-03-9 |
|---|---|
| SMILES | CN1C=CC=C1C(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
(1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone (CAS 121806-03-9), with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol. IUPAC: (1-methylpyrrol-2-yl)-(3-nitrophenyl)methanone.
Chemical Property Profile of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone
Property Insights of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone
The XLogP value of 2.1643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone. The TPSA of 65.14 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone. Following Lipinski's Rule of Five, (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone 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-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone?
The CAS number of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone is 121806-03-9.
What is the molecular formula of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone?
The molecular formula of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone is C12H10N2O3.
What is the molecular weight of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone?
The molecular weight of (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone is 230.07 g/mol.
Where can I buy (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone?
You can request a quote for (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (1-Methylpyrrol-2-yl)-(3-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.