Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide
TL;DR: Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide (CAS 27247-40-1) is a chemical compound with molecular formula C8H14NO5P and molecular weight 235.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(aziridin-1-yl)-5-methyl-2-oxo-1,3,2λ5-dioxaphosphinane-5-carboxylate
Also Known As: methyl 2-(aziridin-1-yl)-5-methyl-2-oxo-1,3,2, methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide, methyl 2-(aziridin-1-yl)-5-methyl-2-oxo-1,3,2lambda5-dioxaphosphi, methyl 2-(aziridin-1-yl)-5-methyl-2-oxo-1,3,2, E5-dioxaphosphinane-5-carboxylate
| Molecular Formula | C8H14NO5P |
|---|---|
| Molecular Weight | 235.06 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 64.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.06096 |
| Heavy Atoms | 15 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 27247-40-1 |
|---|---|
| SMILES | CC1(COP(=O)(OC1)N2CC2)C(=O)OC |
| InChIKey | ZHVFYMXNWLDRCW-UHFFFAOYSA-N |
Product Overview
Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide (CAS 27247-40-1), with molecular formula C8H14NO5P and molecular weight 235.06 g/mol. IUPAC: methyl 2-(aziridin-1-yl)-5-methyl-2-oxo-1,3,2λ5-dioxaphosphinane-5-carboxylate.
Chemical Property Profile of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide
Property Insights of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide
The XLogP value of -0.5 indicates that Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide. Following Lipinski's Rule of Five, Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide has 0 hydrogen bond donor(s) and 6 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 Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide?
The CAS number of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide is 27247-40-1.
What is the molecular formula of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide?
The molecular formula of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide is C8H14NO5P.
What is the molecular weight of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide?
The molecular weight of Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide is 235.06 g/mol.
Where can I buy Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide?
You can request a quote for Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(aziridin-1-yl)-5-methyl-1,3,2-dioxaphosphinane-5-carboxylate 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.