1-(4-Methyl-2-nitrophenyl)guanidine
TL;DR: 1-(4-Methyl-2-nitrophenyl)guanidine (CAS 104235-39-4) is a chemical compound with molecular formula C8H10N4O2 and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-nitrophenyl)guanidine
Also Known As: 2-nitro-4-methylphenylguanidine, 1-(4-Methyl-2-nitrophenyl)guanidine, 2-(4-methyl-2-nitrophenyl)guanidine, 2-(4-methyl-2-nitro-phenyl)guanidine
| Molecular Formula | C8H10N4O2 |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | 0.80812 |
| Topological Polar Surface Area | 107.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.08037 |
| Heavy Atoms | 14 |
| Complexity | 396.3278 |
Chemical Identifiers
| CAS Number | 104235-39-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=C(N)N)[N+](=O)[O-] |
Product Overview
1-(4-Methyl-2-nitrophenyl)guanidine (CAS 104235-39-4), with molecular formula C8H10N4O2 and molecular weight 194.08 g/mol. IUPAC: 2-(4-methyl-2-nitrophenyl)guanidine.
Chemical Property Profile of 1-(4-Methyl-2-nitrophenyl)guanidine
Property Insights of 1-(4-Methyl-2-nitrophenyl)guanidine
The XLogP value of 0.80812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methyl-2-nitrophenyl)guanidine. The TPSA of 107.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methyl-2-nitrophenyl)guanidine. Following Lipinski's Rule of Five, 1-(4-Methyl-2-nitrophenyl)guanidine has 2 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)guanidine?
The CAS number of 1-(4-Methyl-2-nitrophenyl)guanidine is 104235-39-4.
What is the molecular formula of 1-(4-Methyl-2-nitrophenyl)guanidine?
The molecular formula of 1-(4-Methyl-2-nitrophenyl)guanidine is C8H10N4O2.
What is the molecular weight of 1-(4-Methyl-2-nitrophenyl)guanidine?
The molecular weight of 1-(4-Methyl-2-nitrophenyl)guanidine is 194.08 g/mol.
Where can I buy 1-(4-Methyl-2-nitrophenyl)guanidine?
You can request a quote for 1-(4-Methyl-2-nitrophenyl)guanidine 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)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methyl-2-nitrophenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.