Dimethyl butane-1,4-diylbis(nitrosocarbamate)
TL;DR: Dimethyl butane-1,4-diylbis(nitrosocarbamate) (CAS 40283-66-7) is a chemical compound with molecular formula C8H14N4O6 and molecular weight 262.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[4-[methoxycarbonyl(nitroso)amino]butyl]-N-nitrosocarbamate
Also Known As: dimethyl butane-1,4-diylbis(nitrosocarbamate), methyl N-[4-[methoxycarbonyl(nitroso)amino]butyl]-N-nitrosocarbamate, methyl N-[4-[methoxycarbonyl(nitroso)amino]butyl]-N-nitrosoc, Carbamic acid,1,4-butanediylbis[nitroso-, dimethyl ester (9CI), N,N'-dinitroso-N,N'-butanediyl-bis-carbamic acid dimethyl ester
| Molecular Formula | C8H14N4O6 |
|---|---|
| Molecular Weight | 262.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.09134 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 40283-66-7 |
|---|---|
| SMILES | COC(=O)N(CCCCN(C(=O)OC)N=O)N=O |
| InChIKey | WRWJIBVYXNQEGK-UHFFFAOYSA-N |
Product Overview
Dimethyl butane-1,4-diylbis(nitrosocarbamate) (CAS 40283-66-7), with molecular formula C8H14N4O6 and molecular weight 262.09 g/mol. IUPAC: methyl N-[4-[methoxycarbonyl(nitroso)amino]butyl]-N-nitrosocarbamate.
Chemical Property Profile of Dimethyl butane-1,4-diylbis(nitrosocarbamate)
Property Insights of Dimethyl butane-1,4-diylbis(nitrosocarbamate)
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl butane-1,4-diylbis(nitrosocarbamate). The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl butane-1,4-diylbis(nitrosocarbamate). Following Lipinski's Rule of Five, Dimethyl butane-1,4-diylbis(nitrosocarbamate) has 0 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 Dimethyl butane-1,4-diylbis(nitrosocarbamate)?
The CAS number of Dimethyl butane-1,4-diylbis(nitrosocarbamate) is 40283-66-7.
What is the molecular formula of Dimethyl butane-1,4-diylbis(nitrosocarbamate)?
The molecular formula of Dimethyl butane-1,4-diylbis(nitrosocarbamate) is C8H14N4O6.
What is the molecular weight of Dimethyl butane-1,4-diylbis(nitrosocarbamate)?
The molecular weight of Dimethyl butane-1,4-diylbis(nitrosocarbamate) is 262.09 g/mol.
Where can I buy Dimethyl butane-1,4-diylbis(nitrosocarbamate)?
You can request a quote for Dimethyl butane-1,4-diylbis(nitrosocarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl butane-1,4-diylbis(nitrosocarbamate)?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl butane-1,4-diylbis(nitrosocarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.