Hydroxy Cyclophosphamide O-Methyloxime

Base Information

• Chemical Name: Hydroxy Cyclophosphamide O-Methyloxime
• CAS No.: 82084-80-8
• Molecular Formula: C₈H₁₈Cl₂N₃O₃P
• Molecular Weight: 306.129
• Mol file: 82084-80-8.mol

Synonyms:Hydroxy Cyclophosphamide O-Methyloxime;82084-80-8;Phosphorodiamidic acid, N,N-bis(2-chloroethyl)-, 3-(methoxyimino)propyl ester, (E)-

Chemical Property of Hydroxy Cyclophosphamide O-Methyloxime

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 406.4°Cat760mmHg
• Flash Point: 199.6°C
• Density: 1.37g/cm³
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 305.0462838
• Heavy Atom Count: 17
• Complexity: 262

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CON=CCCOP(=O)(N)N(CCCl)CCCl
• Isomeric SMILES: CO/N=C/CCOP(=O)(N)N(CCCl)CCCl

Technology Process of Hydroxy Cyclophosphamide O-Methyloxime

There total 10 articles about Hydroxy Cyclophosphamide O-Methyloxime 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:

trans-4-hydroperoxycyclophosphamide (39800-16-3,56922-83-9,61903-31-9,62435-42-1,146566-40-7) → aldophosphamide O-methyloxime (343967-21-5,82084-80-8)

Guidance literature:

Multi-step reaction with 2 steps

1: Ph₃P / 0.08 h

2: NaOH / D₂O / 0.17 h / lutidine buffer, pH 7.4

With sodium hydroxide; triphenylphosphine; In water-d2;

DOI:10.1002/jps.2600710417

Reference yield:

N-methoxylamine hydrochloride (593-56-6) + trans-4-hydroxycyclophosphamide (61903-30-8,88852-78-2,40277-05-2,61903-29-5,88852-77-1) → aldophosphamide O-methyloxime (343967-21-5,82084-80-8) + (E)-aldophosphamide O-methyl oxime (82084-80-8)

Guidance literature:

With sodium hydroxide; for 0.166667h; Title compound not separated from byproducts; lutidine buffer, pH 7.4;

DOI:10.1002/jps.2600710417

Reference yield:

N-methoxylamine hydrochloride (593-56-6) + trans-4-hydroxycyclophosphamide (61903-30-8,88852-78-2,40277-05-2,61903-29-5,88852-77-1) → aldophosphamide O-methyloxime (343967-21-5,82084-80-8) + (E)-aldophosphamide O-methyl oxime (82084-80-8)

Guidance literature:

With sodium hydroxide; for 0.166667h; Title compound not separated from byproducts; lutidine buffer, pH 7.4;

DOI:10.1002/jps.2600710417

upstream raw materials:

N-methoxylamine hydrochloride

trans-4-hydroxycyclophosphamide

4-hydroperoxycyclophosphamide

4-peroxycyclophosphamide