1,1-Diethylguanidine hydrochloride
TL;DR: 1,1-Diethylguanidine hydrochloride (CAS 1114-39-2) is a chemical compound with molecular formula C5H14ClN3 and molecular weight 151.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethylguanidine;hydrochloride
Also Known As: 1,1-Diethylguanidine hydrochloride, 1,1-Diethylguanidine, 1,1-diethylguanidine;hydrochloride, N,N-Diethylguanidine hydrochloride, N,N-Diethylguanidine HCl
| Molecular Formula | C5H14ClN3 |
|---|---|
| Molecular Weight | 151.09 g/mol |
| LogP | 0.64 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 151.08763 |
| Heavy Atoms | 9 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 1114-39-2 |
|---|---|
| SMILES | CCN(CC)C(=N)N.Cl |
| InChIKey | BUFXTZQKWHOGPE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Diethylguanidine hydrochloride (CAS 1114-39-2), with molecular formula C5H14ClN3 and molecular weight 151.09 g/mol. IUPAC: 1,1-diethylguanidine;hydrochloride.
Chemical Property Profile of 1,1-Diethylguanidine hydrochloride
Property Insights of 1,1-Diethylguanidine hydrochloride
The XLogP value of 0.64 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Diethylguanidine hydrochloride. With a topological polar surface area (TPSA) of 53.1 Ų, 1,1-Diethylguanidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diethylguanidine hydrochloride has 3 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 1,1-Diethylguanidine hydrochloride?
The CAS number of 1,1-Diethylguanidine hydrochloride is 1114-39-2.
What is the molecular formula of 1,1-Diethylguanidine hydrochloride?
The molecular formula of 1,1-Diethylguanidine hydrochloride is C5H14ClN3.
What is the molecular weight of 1,1-Diethylguanidine hydrochloride?
The molecular weight of 1,1-Diethylguanidine hydrochloride is 151.09 g/mol.
Where can I buy 1,1-Diethylguanidine hydrochloride?
You can request a quote for 1,1-Diethylguanidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Diethylguanidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Diethylguanidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.