3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate
TL;DR: 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate (CAS 14186-00-6) is a chemical compound with molecular formula C7H15Cl2N2O3P and molecular weight 276.01974 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bis(2-chloroethylamino)phosphoryloxypropanal
Also Known As: Aldoifosfamide, Aldophosphamide, Aldo-ifosfamide, 3-bis(2-chloroethylamino)phosphoryloxypropanal, 3-oxopropyl n,n'-bis(2-chloroethyl)phosphorodiamidate
Technical Specifications
| Molecular Formula | C7H15Cl2N2O3P |
| Molecular Weight | 276.01974 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 276.01974 Da |
| Heavy Atoms | 15 |
| Complexity | 206.0 |
| SMILES | C(COP(=O)(NCCCl)NCCCl)C=O |
| InChIKey | IPTJZZUYNOWWHM-UHFFFAOYSA-N |
Chemical Property Profile of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate
Property Insights of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate
The XLogP value of -0.4 indicates that 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate. Following Lipinski's Rule of Five, 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The CAS number of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate is 14186-00-6.
What is the molecular formula of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The molecular formula of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate is C7H15Cl2N2O3P.
What is the molecular weight of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The molecular weight of 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate is 276.01974 g/mol.
Where can I buy 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
You can request a quote for 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
Yes, CoreyChem provides custom synthesis services for 3-Oxopropyl N,N'-bis(2-chloroethyl)phosphorodiamidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.