Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester
TL;DR: Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester (CAS 54805-64-0) is a chemical compound with molecular formula C7H14N3O4P and molecular weight 235.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[bis(aziridin-1-yl)phosphoryloxy]carbamate
Also Known As: Carbamic acid, ethyl ester, ((Bis(1-aziridinyl)phosphinyl)oxy)carbamic acid ethyl ester, ethyl N-[bis(aziridin-1-yl)phosphoryloxy]carbamate, O-(Bis(1-aziridinyl)phosphinyl)-N-hydroxyurethane, 5-20-01-00126 (Beilstein Handbook Reference)
| Molecular Formula | C7H14N3O4P |
|---|---|
| Molecular Weight | 235.07 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 70.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 235.07219 |
| Heavy Atoms | 15 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 54805-64-0 |
|---|---|
| SMILES | CCOC(=O)NOP(=O)(N1CC1)N2CC2 |
| InChIKey | BKLLQNOIUMRVRI-UHFFFAOYSA-N |
Product Overview
Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester (CAS 54805-64-0), with molecular formula C7H14N3O4P and molecular weight 235.07 g/mol. IUPAC: ethyl N-[bis(aziridin-1-yl)phosphoryloxy]carbamate.
Chemical Property Profile of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester
Property Insights of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester
The XLogP value of -0.3 indicates that Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester. Following Lipinski's Rule of Five, Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester has 1 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 Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester?
The CAS number of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester is 54805-64-0.
What is the molecular formula of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester?
The molecular formula of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester is C7H14N3O4P.
What is the molecular weight of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester?
The molecular weight of Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester is 235.07 g/mol.
Where can I buy Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester?
You can request a quote for Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, ((bis(1-aziridinyl)phosphinyl)oxy)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.