Guanidine, (p-methylbenzyl)-
TL;DR: Guanidine, (p-methylbenzyl)- (CAS 13333-41-0) is a chemical compound with molecular formula C9H13N3 and molecular weight 163.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)methyl]guanidine
Also Known As: (p-Methylbenzyl)guanidine, 1-(4-Methylbenzyl)guanidine, 4-Guanidinomethyl-toluol, GUANIDINE, (p-METHYLBENZYL)-, 2-[(4-methylphenyl)methyl]guanidine
| Molecular Formula | C9H13N3 |
|---|---|
| Molecular Weight | 163.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.11095 |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 13333-41-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN=C(N)N |
| InChIKey | VZIQPOAQCQRQTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guanidine, (p-methylbenzyl)- (CAS 13333-41-0), with molecular formula C9H13N3 and molecular weight 163.11 g/mol. IUPAC: 2-[(4-methylphenyl)methyl]guanidine.
Chemical Property Profile of Guanidine, (p-methylbenzyl)-
Property Insights of Guanidine, (p-methylbenzyl)-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, (p-methylbenzyl)-. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, (p-methylbenzyl)-. Following Lipinski's Rule of Five, Guanidine, (p-methylbenzyl)- 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
Frequently Asked Questions
What is the CAS number of Guanidine, (p-methylbenzyl)-?
The CAS number of Guanidine, (p-methylbenzyl)- is 13333-41-0.
What is the molecular formula of Guanidine, (p-methylbenzyl)-?
The molecular formula of Guanidine, (p-methylbenzyl)- is C9H13N3.
What is the molecular weight of Guanidine, (p-methylbenzyl)-?
The molecular weight of Guanidine, (p-methylbenzyl)- is 163.11 g/mol.
Where can I buy Guanidine, (p-methylbenzyl)-?
You can request a quote for Guanidine, (p-methylbenzyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, (p-methylbenzyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, (p-methylbenzyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.