N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)
TL;DR: N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) (CAS 64773-89-3) is a chemical compound with molecular formula C8H16N10O6 and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-1-[6-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]hexyl]-1-nitrosoguanidine
Also Known As: Guanidine, N,N''-1,6-hexanediylbis(N-nitro-N-nitroso-, N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine), 2-nitro-1-[6-[(N'-nitrocarbamimidoyl)-nitroso-amino]hexyl]-1-nitroso-guanidine
| Molecular Formula | C8H16N10O6 |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | -0.4736 |
| Topological Polar Surface Area | 228.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 348.12543 |
| Heavy Atoms | 24 |
| Complexity | 475.47775 |
Chemical Identifiers
| CAS Number | 64773-89-3 |
|---|---|
| SMILES | C(CCN(N=O)/C(=N/[N+](=O)[O-])/N)CCCN(N=O)/C(=N/[N+](=O)[O-])/N |
Product Overview
N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) (CAS 64773-89-3), with molecular formula C8H16N10O6 and molecular weight 348.13 g/mol. IUPAC: 2-nitro-1-[6-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]hexyl]-1-nitrosoguanidine.
Chemical Property Profile of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)
Property Insights of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)
The XLogP value of -0.4736 indicates that N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 228.38 Ų indicates high polarity, suggesting N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) has 2 hydrogen bond donor(s) and 8 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'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)?
The CAS number of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) is 64773-89-3.
What is the molecular formula of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)?
The molecular formula of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) is C8H16N10O6.
What is the molecular weight of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)?
The molecular weight of N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) is 348.13 g/mol.
Where can I buy N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)?
You can request a quote for N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine)?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Hexane-1,6-diylbis(N''-nitro-N-nitrosoguanidine) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.