2-(2-Chloroethyl)-1-nitroguanidine
TL;DR: 2-(2-Chloroethyl)-1-nitroguanidine (CAS 6937-92-4) is a chemical compound with molecular formula C3H7ClN4O2 and molecular weight 166.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroethyl)-1-nitroguanidine
Also Known As: NCIOpen2_002227, 2-(2-chloroethyl)-1-nitroguanidine, N''-(2-Chloroethyl)-N-nitroguanidine
| Molecular Formula | C3H7ClN4O2 |
|---|---|
| Molecular Weight | 166.03 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.02576 |
| Heavy Atoms | 10 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 6937-92-4 |
|---|---|
| SMILES | C(CCl)N=C(N)N[N+](=O)[O-] |
| InChIKey | AGWJWWQYEREDAU-UHFFFAOYSA-N |
Product Overview
2-(2-Chloroethyl)-1-nitroguanidine (CAS 6937-92-4), with molecular formula C3H7ClN4O2 and molecular weight 166.03 g/mol. IUPAC: 2-(2-chloroethyl)-1-nitroguanidine.
Chemical Property Profile of 2-(2-Chloroethyl)-1-nitroguanidine
Property Insights of 2-(2-Chloroethyl)-1-nitroguanidine
The XLogP value of -0.2 indicates that 2-(2-Chloroethyl)-1-nitroguanidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Chloroethyl)-1-nitroguanidine. Following Lipinski's Rule of Five, 2-(2-Chloroethyl)-1-nitroguanidine 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 2-(2-Chloroethyl)-1-nitroguanidine?
The CAS number of 2-(2-Chloroethyl)-1-nitroguanidine is 6937-92-4.
What is the molecular formula of 2-(2-Chloroethyl)-1-nitroguanidine?
The molecular formula of 2-(2-Chloroethyl)-1-nitroguanidine is C3H7ClN4O2.
What is the molecular weight of 2-(2-Chloroethyl)-1-nitroguanidine?
The molecular weight of 2-(2-Chloroethyl)-1-nitroguanidine is 166.03 g/mol.
Where can I buy 2-(2-Chloroethyl)-1-nitroguanidine?
You can request a quote for 2-(2-Chloroethyl)-1-nitroguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroethyl)-1-nitroguanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroethyl)-1-nitroguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.