dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate
TL;DR: dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate (CAS 1883-80-3) is a chemical compound with molecular formula C8H11NO4 and molecular weight 185.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate
Also Known As: dimethyl 2-(aziridin-1-yl)maleate, dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate, Dimethyl (2E)-2-(aziridin-1-yl)but-2-enedioate
| Molecular Formula | C8H11NO4 |
|---|---|
| Molecular Weight | 185.07 g/mol |
| LogP | -0.4681 |
| Topological Polar Surface Area | 55.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.0688 |
| Heavy Atoms | 13 |
| Complexity | 254.86964 |
Chemical Identifiers
| CAS Number | 1883-80-3 |
|---|---|
| SMILES | COC(=O)/C=C(\C(=O)OC)/N1CC1 |
Product Overview
dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate (CAS 1883-80-3), with molecular formula C8H11NO4 and molecular weight 185.07 g/mol. IUPAC: dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate.
Chemical Property Profile of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate
Property Insights of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate
The XLogP value of -0.4681 indicates that dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.61 Ų, dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate has 0 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 dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate?
The CAS number of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate is 1883-80-3.
What is the molecular formula of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate?
The molecular formula of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate is C8H11NO4.
What is the molecular weight of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate?
The molecular weight of dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate is 185.07 g/mol.
Where can I buy dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate?
You can request a quote for dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl (E)-2-(aziridin-1-yl)but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.