4-(S-Ethanol)-sulfido-cyclophosphamide

Base Information

• Chemical Name: 4-(S-Ethanol)-sulfido-cyclophosphamide
• CAS No.: 65882-95-3
• Molecular Formula: C9H19Cl2N2O3PS
• Molecular Weight: 337.2035
• Mol file: 65882-95-3.mol

Synonyms:4-(S-ethanol)-sulfido-cyclophosphamide;sodium 5-(2,2-dimethylpropyl)-5-methyl-4-oxo-4,5-dihydro-1,3-oxazol-2-olate;

Chemical Property of 4-(S-Ethanol)-sulfido-cyclophosphamide

Chemical Property:

• Vapor Pressure: 5.13E-11mmHg at 25°C
• Boiling Point: 475°Cat760mmHg
• Flash Point: 241°C
• PSA: 61.72000
• Density: 1.4g/cm³
• LogP: 1.59610

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

4-(S-ETHANOL)SULFIDO CYCLOPHOSPHAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(S-Ethanol)-sulfido-cyclophosphamide

There total 4 articles about 4-(S-Ethanol)-sulfido-cyclophosphamide 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:

O-3-buten-1-yl N,N-bis(2-chloroethyl)phosphorodiamidate (39800-29-8) → 4-(S-ethanol)-sulfido-cyclophosphamide (65882-95-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 27 percent / ozone, 30percent aq. H₂O₂ / acetone; H₂O / Ambient temperature

2: 1.) Ph₃P, 2.) trichloroacetic acid / 1.) CH₂Cl₂, RT, 15 min, 2.) CH₂Cl₂, 5 deg C, 1 h

With dihydrogen peroxide; ozone; triphenylphosphine; trichloroacetic acid; In water; acetone;

DOI:10.1021/jm00370a008

Reference yield:

trans-4-hydroperoxycyclophosphamide (39800-16-3,56922-83-9,61903-31-9,62435-42-1,146566-40-7) + 2-hydroxyethanethiol (60-24-2) → 4-(S-ethanol)-sulfido-cyclophosphamide (65882-95-3)

Guidance literature:

With triphenylphosphine; trichloroacetic acid; Multistep reaction; 1.) CH₂Cl₂, RT, 15 min, 2.) CH₂Cl₂, 5 deg C, 1 h;

DOI:10.1021/jm00370a008

Reference yield:

4-hydroxycyclophosphamide (40277-05-2) + 2-hydroxyethanethiol (60-24-2) → 4-(S-ethanol)-sulfido-cyclophosphamide (65882-95-3)

Guidance literature:

In dichloromethane;

DOI:10.1002/bms.1200040404

upstream raw materials:

4-hydroxycyclophosphamide

2-hydroxyethanethiol

trans-4-hydroperoxycyclophosphamide

O-3-buten-1-yl N,N-bis(2-chloroethyl)phosphorodiamidate