Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
TL;DR: Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester (CAS 78218-72-1) is a chemical compound with molecular formula C12H17Cl3NO3P and molecular weight 359.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[2-chloroethoxy(phenoxy)phosphoryl]-N-(2-chloroethyl)ethanamine
Also Known As: B 803, 2-Chloroethyl phenyl N,N-bis(2-chloroethyl)phosphoramidate, B-803, Phosphoramidic acid, 2-chloroethyl phenyl ester, Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
| Molecular Formula | C12H17Cl3NO3P |
|---|---|
| Molecular Weight | 359.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 359.00116 |
| Heavy Atoms | 20 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 78218-72-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)OP(=O)(N(CCCl)CCCl)OCCCl |
| InChIKey | CCJANWHEDDRRBP-UHFFFAOYSA-N |
Product Overview
Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester (CAS 78218-72-1), with molecular formula C12H17Cl3NO3P and molecular weight 359.00 g/mol. IUPAC: 2-chloro-N-[2-chloroethoxy(phenoxy)phosphoryl]-N-(2-chloroethyl)ethanamine.
Chemical Property Profile of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
Property Insights of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester
The XLogP value of 3.3 indicates that Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester has 0 hydrogen bond donor(s) and 4 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 Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester?
The CAS number of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester is 78218-72-1.
What is the molecular formula of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester?
The molecular formula of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester is C12H17Cl3NO3P.
What is the molecular weight of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester?
The molecular weight of Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester is 359.00 g/mol.
Where can I buy Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester?
You can request a quote for Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidic acid, N,N-bis(2-chloroethyl)-, O-(2-chloroethyl)-O-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.