![2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid structure](/static/products/916/91688-07-2.png)
2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid
TL;DR: 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid (CAS 91688-07-2) 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.
2-[4-[carboxymethyl(nitroso)amino]butyl-nitrosoamino]acetic acid
Also Known As: 2,2'-[butane-1,4-diylbis(nitrosoimino)]diacetic acid, N,N'-Dinitroso-N,N'-butandiyl-bis-glycin, 2-[4-[carboxymethyl(nitroso)amino]butyl-nitrosoamino]acetic acid, 2,2'-[Butane-1,4-diylbis(nitrosoazanediyl)]diacetic acid
| Molecular Formula | C8H14N4O6 |
|---|---|
| Molecular Weight | 262.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 262.09134 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 91688-07-2 |
|---|---|
| SMILES | C(CCN(CC(=O)O)N=O)CN(CC(=O)O)N=O |
| InChIKey | XCFYPWQDKOXJLX-UHFFFAOYSA-N |
Product Overview
2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid (CAS 91688-07-2), with molecular formula C8H14N4O6 and molecular weight 262.09 g/mol. IUPAC: 2-[4-[carboxymethyl(nitroso)amino]butyl-nitrosoamino]acetic acid.
Chemical Property Profile of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid
Property Insights of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid. The TPSA of 140.0 Ų indicates high polarity, suggesting 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid has 2 hydrogen bond donor(s) and 10 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'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid?
The CAS number of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid is 91688-07-2.
What is the molecular formula of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid?
The molecular formula of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid is C8H14N4O6.
What is the molecular weight of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid?
The molecular weight of 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid is 262.09 g/mol.
Where can I buy 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid?
You can request a quote for 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-[Butane-1,4-diylbis(nitrosoimino)]diacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.