1-Butyl-2-nitro-1-nitroso-guanidine
TL;DR: 1-Butyl-2-nitro-1-nitroso-guanidine (CAS 13010-08-7) is a chemical compound with molecular formula C5H11N5O3 and molecular weight 189.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2-nitro-1-nitrosoguanidine
Also Known As: 1-butyl-2-nitro-1-nitroso-guanidine, 1-butyl-2-nitro-1-nitrosoguanidine
| Molecular Formula | C5H11N5O3 |
|---|---|
| Molecular Weight | 189.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 189.08618 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 13010-08-7 |
|---|---|
| SMILES | CCCCN(C(=N[N+](=O)[O-])N)N=O |
| InChIKey | FJNCPBNCTRDXFB-UHFFFAOYSA-N |
Product Overview
1-Butyl-2-nitro-1-nitroso-guanidine (CAS 13010-08-7), with molecular formula C5H11N5O3 and molecular weight 189.09 g/mol. IUPAC: 1-butyl-2-nitro-1-nitrosoguanidine.
Chemical Property Profile of 1-Butyl-2-nitro-1-nitroso-guanidine
Property Insights of 1-Butyl-2-nitro-1-nitroso-guanidine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-2-nitro-1-nitroso-guanidine. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butyl-2-nitro-1-nitroso-guanidine. Following Lipinski's Rule of Five, 1-Butyl-2-nitro-1-nitroso-guanidine has 1 hydrogen bond donor(s) and 5 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-Butyl-2-nitro-1-nitroso-guanidine?
The CAS number of 1-Butyl-2-nitro-1-nitroso-guanidine is 13010-08-7.
What is the molecular formula of 1-Butyl-2-nitro-1-nitroso-guanidine?
The molecular formula of 1-Butyl-2-nitro-1-nitroso-guanidine is C5H11N5O3.
What is the molecular weight of 1-Butyl-2-nitro-1-nitroso-guanidine?
The molecular weight of 1-Butyl-2-nitro-1-nitroso-guanidine is 189.09 g/mol.
Where can I buy 1-Butyl-2-nitro-1-nitroso-guanidine?
You can request a quote for 1-Butyl-2-nitro-1-nitroso-guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-2-nitro-1-nitroso-guanidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-2-nitro-1-nitroso-guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.