2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile
TL;DR: 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile (CAS 719-48-2) is a chemical compound with molecular formula C9H8ClN3O3 and molecular weight 241.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-(methoxymethyl)-6-methyl-5-nitropyridine-3-carbonitrile
Also Known As: 1-Boc-3-iodoindole, 2-chloro-4-(methoxymethyl)-6-methyl-5-nitropyridine-3-carbonitrile, NICOTINONITRILE, 2-CHLORO-4-(METHOXYMETHYL)-6-METHYL-5-NITRO-, ZERO/000216, 3-Pyridinecarbonitrile, 2-chloro-4-(methoxymethyl)-6-methyl-5-nitro-
| Molecular Formula | C9H8ClN3O3 |
|---|---|
| Molecular Weight | 241.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.02542 |
| Heavy Atoms | 16 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 719-48-2 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)Cl)C#N)COC)[N+](=O)[O-] |
| InChIKey | KGHLPTCKXVCLBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile (CAS 719-48-2), with molecular formula C9H8ClN3O3 and molecular weight 241.03 g/mol. IUPAC: 2-chloro-4-(methoxymethyl)-6-methyl-5-nitropyridine-3-carbonitrile.
Chemical Property Profile of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile
Property Insights of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile. Following Lipinski's Rule of Five, 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile has 0 hydrogen bond donor(s) and 5 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 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile?
The CAS number of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile is 719-48-2.
What is the molecular formula of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile?
The molecular formula of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile is C9H8ClN3O3.
What is the molecular weight of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile?
The molecular weight of 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile is 241.03 g/mol.
Where can I buy 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile?
You can request a quote for 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-(methoxymethyl)-6-methyl-5-nitro-3-pyridinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.