4,6-Ditert-butyl-3-nitro-2-methylphenylformamide
TL;DR: 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide (CAS 101270-19-3) is a chemical compound with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-ditert-butyl-2-methyl-3-nitrophenyl)formamide
Also Known As: 4,6-ditert-butyl-3-nitro-2-methylphenylformamide, N-(4,6-ditert-butyl-2-methyl-3-nitrophenyl)formamide, AE-562/12222159, N-(4,6-Di-tert-butyl-2-methyl-3-nitrophenyl)formamide
| Molecular Formula | C16H24N2O3 |
|---|---|
| Molecular Weight | 292.18 g/mol |
| LogP | 4.06652 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.17868 |
| Heavy Atoms | 21 |
| Complexity | 578.6556 |
Chemical Identifiers
| CAS Number | 101270-19-3 |
|---|---|
| SMILES | CC1=C(C(=CC(=C1[N+](=O)[O-])C(C)(C)C)C(C)(C)C)NC=O |
Product Overview
4,6-Ditert-butyl-3-nitro-2-methylphenylformamide (CAS 101270-19-3), with molecular formula C16H24N2O3 and molecular weight 292.18 g/mol. IUPAC: N-(4,6-ditert-butyl-2-methyl-3-nitrophenyl)formamide.
Chemical Property Profile of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide
Property Insights of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide
The XLogP value of 4.06652 indicates that 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide. Following Lipinski's Rule of Five, 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide has 1 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 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide?
The CAS number of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide is 101270-19-3.
What is the molecular formula of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide?
The molecular formula of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide is C16H24N2O3.
What is the molecular weight of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide?
The molecular weight of 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide is 292.18 g/mol.
Where can I buy 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide?
You can request a quote for 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Ditert-butyl-3-nitro-2-methylphenylformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.