Dimethyl 2-(aziridin-1-yl)butanedioate
TL;DR: Dimethyl 2-(aziridin-1-yl)butanedioate (CAS 32773-98-1) is a chemical compound with molecular formula C8H13NO4 and molecular weight 187.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(aziridin-1-yl)butanedioate
Also Known As: dimethyl 2-(aziridin-1-yl)butanedioate, dimethyl 2-aziridin-1-ylbutanedioate, 1-[1,2-bis(carbomethoxy)ethyl]aziridine, RefChem:338508
| Molecular Formula | C8H13NO4 |
|---|---|
| Molecular Weight | 187.08 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 187.08446 |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 32773-98-1 |
|---|---|
| SMILES | COC(=O)CC(C(=O)OC)N1CC1 |
| InChIKey | ADPVKLHIGNFTOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethyl 2-(aziridin-1-yl)butanedioate (CAS 32773-98-1), with molecular formula C8H13NO4 and molecular weight 187.08 g/mol. IUPAC: dimethyl 2-(aziridin-1-yl)butanedioate.
Chemical Property Profile of Dimethyl 2-(aziridin-1-yl)butanedioate
Property Insights of Dimethyl 2-(aziridin-1-yl)butanedioate
The XLogP value of -0.2 indicates that Dimethyl 2-(aziridin-1-yl)butanedioate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.6 Ų, Dimethyl 2-(aziridin-1-yl)butanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 2-(aziridin-1-yl)butanedioate 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 2-(aziridin-1-yl)butanedioate?
The CAS number of Dimethyl 2-(aziridin-1-yl)butanedioate is 32773-98-1.
What is the molecular formula of Dimethyl 2-(aziridin-1-yl)butanedioate?
The molecular formula of Dimethyl 2-(aziridin-1-yl)butanedioate is C8H13NO4.
What is the molecular weight of Dimethyl 2-(aziridin-1-yl)butanedioate?
The molecular weight of Dimethyl 2-(aziridin-1-yl)butanedioate is 187.08 g/mol.
Where can I buy Dimethyl 2-(aziridin-1-yl)butanedioate?
You can request a quote for Dimethyl 2-(aziridin-1-yl)butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-(aziridin-1-yl)butanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-(aziridin-1-yl)butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.