Benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate

Base Information

• Chemical Name: Benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate
• CAS No.: 18228-78-9
• Molecular Formula: C14H23Cl2N2O3P
• Molecular Weight: 369.2238
• NSC Number: 72511
• DSSTox Substance ID: DTXSID70291029
• ChEMBL ID: CHEMBL1968888
• Mol file: 18228-78-9.mol

Synonyms:18228-78-9;NSC72511;benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate;NCIOpen2_008931;CHEMBL1968888;DTXSID70291029;NSC-72511;NCI60_041579;Phosphordiamidic acid,N-bis(2-chloroethyl)-N'-(3-hydroxypropyl)-, benzyl ester

Chemical Property of Benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate

Chemical Property:

• Boiling Point: 496°Cat760mmHg
• Flash Point: 253.8°C
• Density: 1.281g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 368.0823350
• Heavy Atom Count: 22
• Complexity: 325

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COP(=O)(NCCCO)N(CCCl)CCCl

Technology Process of Benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate

There total 1 articles about Benzyl n,n-bis(2-chloroethyl)-n'-(3-hydroxypropyl)phosphorodiamidate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

sodium phenyl-methanolate (20194-18-7) → Phosphorsaeure-benzylester--(3hydroxy-propylamid) (18228-78-9)

Guidance literature:

DOI:10.1021/jm00337a012

Reference yield:

Phosphorsaeure-benzylester--(3hydroxy-propylamid) (18228-78-9) → Phosphorsaeure--(3-hydroxy-propylamid) (14504-75-7)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1021/jm00337a012

upstream raw materials:

sodium phenyl-methanolate

Downstream raw materials:

Phosphorsaeure--(3-hydroxy-propylamid)

Refernces