N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester
TL;DR: N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester (CAS 210835-70-4) is a chemical compound with molecular formula C12H14N4O6 and molecular weight 310.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(2-methoxy-2-oxoethyl)-nitrosoamino]-N-nitrosoanilino]acetate
Also Known As: N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester, J1.348.375B, methyl 2-[4-[(2-methoxy-2-oxoethyl)-nitrosoamino]-N-nitrosoanilino]acetate, N,N'-1,4-Phenylenebis[N-nitrosoglycine], dimethyl ester, [p-Phenylenebis(nitrosoimino)]bis(acetic acid methyl) ester
| Molecular Formula | C12H14N4O6 |
|---|---|
| Molecular Weight | 310.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.09134 |
| Heavy Atoms | 22 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 210835-70-4 |
|---|---|
| SMILES | COC(=O)CN(C1=CC=C(C=C1)N(CC(=O)OC)N=O)N=O |
| InChIKey | YBJVWRZFWFUJPT-UHFFFAOYSA-N |
Product Overview
N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester (CAS 210835-70-4), with molecular formula C12H14N4O6 and molecular weight 310.09 g/mol. IUPAC: methyl 2-[4-[(2-methoxy-2-oxoethyl)-nitrosoamino]-N-nitrosoanilino]acetate.
Chemical Property Profile of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester
Property Insights of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester. Following Lipinski's Rule of Five, N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester has 0 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 N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester?
The CAS number of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester is 210835-70-4.
What is the molecular formula of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester?
The molecular formula of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester is C12H14N4O6.
What is the molecular weight of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester?
The molecular weight of N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester is 310.09 g/mol.
Where can I buy N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester?
You can request a quote for N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid Dimethyl Ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.