N-(4-ethylphenyl)guanidine
TL;DR: N-(4-ethylphenyl)guanidine (CAS 1112991-08-8) is a chemical compound with molecular formula C9H13N3 and molecular weight 163.11095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-ethylphenyl)guanidine
Also Known As: N-(4-ethylphenyl)guanidine, 1-(4-ethylphenyl)guanidine, 2-(4-ethylphenyl)guanidine, 1-guanidino-4-ethylbenzene, Guanidine, (4-ethylphenyl)-
Technical Specifications
| Molecular Formula | C9H13N3 |
| Molecular Weight | 163.11095 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.11095 Da |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
| SMILES | CCC1=CC=C(C=C1)N=C(N)N |
| InChIKey | UOSZGPBYQCNGKB-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-ethylphenyl)guanidine
Property Insights of N-(4-ethylphenyl)guanidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-ethylphenyl)guanidine. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-ethylphenyl)guanidine. Following Lipinski's Rule of Five, N-(4-ethylphenyl)guanidine has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-ethylphenyl)guanidine?
The CAS number of N-(4-ethylphenyl)guanidine is 1112991-08-8.
What is the molecular formula of N-(4-ethylphenyl)guanidine?
The molecular formula of N-(4-ethylphenyl)guanidine is C9H13N3.
What is the molecular weight of N-(4-ethylphenyl)guanidine?
The molecular weight of N-(4-ethylphenyl)guanidine is 163.11095 g/mol.
Where can I buy N-(4-ethylphenyl)guanidine?
You can request a quote for N-(4-ethylphenyl)guanidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-ethylphenyl)guanidine?
Yes, CoreyChem provides custom synthesis services for N-(4-ethylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.