3-Hydroxypropanimidamide

Base Information

• Chemical Name: 3-Hydroxypropanimidamide
• CAS No.: 128648-99-7
• Molecular Formula: C₃H₈N₂O
• Molecular Weight: 88.1093
• Hs Code.: 2925290090
• DSSTox Substance ID: DTXSID60402809
• Wikidata: Q82206306
• Mol file: 128648-99-7.mol

Synonyms:3-hydroxypropanimidamide;128648-99-7;3-HYDROXY-PROPIONAMIDINE;DTXSID60402809;AKOS009112496;EN300-55788;F76936

Chemical Property of 3-Hydroxypropanimidamide

Chemical Property:

• Vapor Pressure: 0.0459mmHg at 25°C
• Boiling Point: 209.7°C at 760 mmHg
• Flash Point: 80.6°C
• PSA: 70.10000
• Density: 1.24g/cm³
• LogP: 0.10480
• XLogP3: -1.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 88.063662883
• Heavy Atom Count: 6
• Complexity: 52.8

Purity/Quality:

98% ^*data from raw suppliers

3-HYDROXY-PROPIONAMIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CO)C(=N)N

Technology Process of 3-Hydroxypropanimidamide

There total 2 articles about 3-Hydroxypropanimidamide 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: 15.0%

3-Hydroxypropionitrile (109-78-4) → prop-2-enamidine (19408-49-2,121364-00-9) + hydroxyethyl amidine (128648-99-7)

Guidance literature:

With amino(methyl)aluminum chloride; In toluene; at 80 ℃;

DOI:10.1016/S0040-4039(00)88891-7

Reference yield:

1-methyl-3-tertbutyloxycarbonylamino-2,3,4,5-tetrahydro-2,5-dioxobenzazepine (169681-41-8) + 3-tertbutyloxycarbonylamino-2,3,4,5-tetrahydro-2-thio-5-oxo-benzo[b]azepine (169681-49-6) + (S)-Alaninol (2749-11-3) + mercury (II) chloride (7487-94-7) → hydroxyethyl amidine (128648-99-7)

Guidance literature:

In ethyl acetate;

upstream raw materials:

3-Hydroxypropionitrile

1-methyl-3-tertbutyloxycarbonylamino-2,3,4,5-tetrahydro-2,5-dioxobenzazepine

3-tertbutyloxycarbonylamino-2,3,4,5-tetrahydro-2-thio-5-oxo-benzo[b]azepine

(S)-Alaninol

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