Butafosfan

Base Information

• Chemical Name: Butafosfan
• CAS No.: 17316-67-5
• Molecular Formula: C7H18NO2P
• Molecular Weight: 179.199
• Hs Code.: 2919900090
• European Community (EC) Number: 241-341-7
• UNII: 3Q2LQ1149L
• DSSTox Substance ID: DTXSID5048681,DTXSID00860202
• Wikidata: Q27257890
• NCI Thesaurus Code: C73233
• RXCUI: 819929
• ChEMBL ID: CHEMBL1979022
• Mol file: 17316-67-5.mol

Synonyms:2-(butylamino)propan-2-yl)phosphinic acid;butafosfan;butaphosphan

Chemical Property of Butafosfan

Chemical Property:

• Melting Point: 219 °C
• Boiling Point: 273.4 °C at 760 mmHg
• PKA: 2.99±0.10(Predicted)
• Flash Point: 119.2 °C
• PSA: 72.80000
• LogP: 1.97010
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: Methanol (Slightly), Water (Slightly)
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 178.09969078
• Heavy Atom Count: 11
• Complexity: 136

Purity/Quality:

98% ^*data from raw suppliers

Butafosfan ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCNC(C)(C)[P+](=O)O
• Description: 2-(Butylamino)propan-2-yl-hydroxy-oxophosphanium is a synthetically produced organic phosphorous (phosphonic acid) compound contains 17.3% phosphorus. It is classified as a veterinary pharmaceutical agent.
• Uses and Mechanism of Action: 2-(Butylamino)propan-2-yl-hydroxy-oxophosphanium, in combination with vitamin B12, is used in veterinary medicine for transition dairy cows. It is used for the prevention and treatment of metabolic and reproductive diseases, subclinical and secondary ketosis, displaced abomasum, milk fever, improvement of postoperative rumen activity, uterus involution, and mastitis in transition dairy cows. 2-(Butylamino)propan-2-yl-hydroxy-oxophosphanium, in combination with vitamin B12, acts as a metabolic stimulant interfering with energy metabolism in transition dairy cows. It functions as a cofactor for enzymes involved in metabolic processes, such as methionine synthase and methylmalonyl-CoA mutase.
• History: 2-(Butylamino)propan-2-yl-hydroxy-oxophosphanium has been available for veterinary use since 1958, with the first publication appearing in the 1970s regarding its use in cows.

Technology Process of Butafosfan

There total 1 articles about Butafosfan 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:

N-butylamine (109-73-9,85404-21-3) + acetone (67-64-1) → (1-butylamino-1-methyl)ethylphosphonic acid (17316-67-5)

Guidance literature:

With hypophosphorous acid;

DOI:10.1002/ardp.19673001010

upstream raw materials:

N-butylamine

acetone

Refernces