1-Amino-2-propyl sulfate

Base Information

• Chemical Name: 1-Amino-2-propyl sulfate
• CAS No.: 926-25-0
• Deprecated CAS: 114080-82-9
• Molecular Formula: C3H9 N O4 S
• Molecular Weight: 155.175
• Hs Code.: 2923900090
• European Community (EC) Number: 213-134-1
• NSC Number: 161607
• DSSTox Substance ID: DTXSID50275943,DTXSID10862474
• Nikkaji Number: J298.493H
• Mol file: 926-25-0.mol

Synonyms:1-Amino-2-propyl sulfate;926-25-0;1-Amino-2-propanol, monosulfate ester;1-Amino-2-propyl hydrogen sulfate;2-Ammonio-1-methylethyl sulphate;2-Propanol, 1-amino-, hydrogen sulfate (ester);EINECS 213-134-1;NSC 161607;2-Propanol, 1-amino-, 2-(hydrogen sulfate);C3H9NO4S;1-aminopropan-2-yl hydrogen sulfate;NSC161607;2-amino-1-methylethyl hydrogen sulfate;SCHEMBL1343067;DTXSID10862474;DTXSID50275943;2-amino-1methylethyl hydrogen sulfate;2-Propanol, hydrogen sulfate (ester);AKOS006325856;NSC-161607;Sulfuric acid 1-methyl-2-aminoethyl ester;114080-82-9

Chemical Property of 1-Amino-2-propyl sulfate

Chemical Property:

• Melting Point: 236-238 °C
• Boiling Point: °Cat760mmHg
• PKA: -4.04±0.18(Predicted)
• Flash Point: °C
• PSA: 98.00000
• Density: 1.45g/cm³
• LogP: 0.93410
• XLogP3: -3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 155.02522894
• Heavy Atom Count: 9
• Complexity: 157

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CN)OS(=O)(=O)O

Technology Process of 1-Amino-2-propyl sulfate

There total 2 articles about 1-Amino-2-propyl sulfate 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: 96.2%

3-amino-2-propanol (78-96-6,1674-56-2) → 2-amino-1-methlethyl hydrogen sulfate (926-25-0)

Guidance literature:

With chlorosulfonic acid; In dichloromethane; acetone; at 2 ℃; for 2h; Solvent; Temperature; Inert atmosphere;

Reference yield:

→ 2-amino-1-methlethyl hydrogen sulfate (926-25-0)

Guidance literature:

1-Amino-2-propanol (II), 50percent-H2SO4 ;

Reference yield: 84.3%

2-amino-1-methlethyl hydrogen sulfate (926-25-0) → 2-Methylaziridine (75-55-8,41927-28-0,76612-76-5,76612-77-6,205537-16-2)

Guidance literature:

With sodium hydroxide; In water; at 20 ℃; Temperature;

upstream raw materials:

3-amino-2-propanol

Downstream raw materials:

2-Methylaziridine

N¹,N¹-diethyl-1-methyl-ethanediyldiamine

5-Methyl-2-(-<2-phenyl-ethylamino>)-thiazolin

1-(5-methyl-4,5-dihydro-thiazol-2-yl)-1,3-diphenyl-thiourea

Refernces

• 1、 Li, Xinyao,Chen, Ning,Xu, Jiaxi. "An improved and mild wenker synthesis of aziridines". experimental part. p. 3423 - 3428. Retrieved 2010/11/21.
• 2、 Zhang, Wei,Wang, Boyuan,Chen, Ning,Du, Da-Ming,Xu, Jiaxi. "Expeditious and practical synthesis of various substituted taurines from amino alcohols". . p. 197 - 200. Retrieved 2008/12/20.