N,N',N''-Trimethylguanidine
TL;DR: N,N',N''-Trimethylguanidine (CAS 6145-43-3) is a chemical compound with molecular formula C4H11N3 and molecular weight 101.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-trimethylguanidine
Also Known As: 1,2,3-trimethylguanidine, N,N',N''-Trimethylguanidine, 1,2,3-Trimethylguanidin, N,N',N''-trimethyl-guanidine, Guanidine, 1,2,3-trimethyl-
| Molecular Formula | C4H11N3 |
|---|---|
| Molecular Weight | 101.10 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 101.0953 |
| Heavy Atoms | 7 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 6145-43-3 |
|---|---|
| SMILES | CNC(=NC)NC |
| InChIKey | XKFPXMVATQCVKN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N',N''-Trimethylguanidine (CAS 6145-43-3), with molecular formula C4H11N3 and molecular weight 101.10 g/mol. IUPAC: 1,2,3-trimethylguanidine.
Chemical Property Profile of N,N',N''-Trimethylguanidine
Property Insights of N,N',N''-Trimethylguanidine
The XLogP value of -0.5 indicates that N,N',N''-Trimethylguanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.4 Ų, N,N',N''-Trimethylguanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N',N''-Trimethylguanidine 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 N,N',N''-Trimethylguanidine?
The CAS number of N,N',N''-Trimethylguanidine is 6145-43-3.
What is the molecular formula of N,N',N''-Trimethylguanidine?
The molecular formula of N,N',N''-Trimethylguanidine is C4H11N3.
What is the molecular weight of N,N',N''-Trimethylguanidine?
The molecular weight of N,N',N''-Trimethylguanidine is 101.10 g/mol.
Where can I buy N,N',N''-Trimethylguanidine?
You can request a quote for N,N',N''-Trimethylguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N',N''-Trimethylguanidine?
Yes, KEHONG BIO provides custom synthesis services for N,N',N''-Trimethylguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.