3-Aminopropyl hydrogen sulfate

Base Information

• Chemical Name: 3-Aminopropyl hydrogen sulfate
• CAS No.: 1071-29-0
• Molecular Formula: C3H9 N O4 S
• Molecular Weight: 155.175
• NSC Number: 161610
• DSSTox Substance ID: DTXSID60303786
• Nikkaji Number: J1.851.484B
• Wikidata: Q82049246
• Mol file: 1071-29-0.mol

Synonyms:3-aminopropyl hydrogen sulfate;1071-29-0;3-azanylpropyl hydrogen sulfate;sulfuric acid 3-aminopropyl ester;NSC161610;3-aminopropyl hydrogen sulate;(3-aminopropoxy)sulfonic acid;SCHEMBL5424137;3-amino-propyl hydrogen sulfate;DTXSID60303786;CHEBI:185969;LZOFQGWJBGZHMW-UHFFFAOYSA-N;NSC-161610;A801666

Chemical Property of 3-Aminopropyl hydrogen sulfate

Chemical Property:

• Density: 1.455g/cm³
• XLogP3: -3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 155.02522894
• Heavy Atom Count: 9
• Complexity: 146

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CN)COS(=O)(=O)O

Technology Process of 3-Aminopropyl hydrogen sulfate

There total 3 articles about 3-Aminopropyl hydrogen 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: 87.0%

propan-1-ol-3-amine (156-87-6) → 3-aminopropyl hydrogen sulfate (1071-29-0)

Guidance literature:

With chlorosulfonic acid; In tetrachloromethane; Cooling with ice;

Reference yield:

→ 3-aminopropyl hydrogen sulfate (1071-29-0)

Guidance literature:

With water; silver sulfate;

Reference yield:

→ 3-aminopropyl hydrogen sulfate (1071-29-0)

Guidance literature:

3-Amino-1-propanol, H2SO4;

upstream raw materials:

propan-1-ol-3-amine

Downstream raw materials:

1-amino-3-(dimethylamino)propane

azetidine

Refernces

• 1、 Amir, Nagina,Motonishi, Masaru,Fujita, Mitsuharu,Miyashita, Yoshitaro,Fujisawa, Kiyoshi,Okamoto, Ken-Ichi. "Synthesis of novel S-bridged heterotrinuclear complexes containing six-membered chelate rings: Structural, spectroscopic, and electrochemical properties of [Co{Rh(apt)3}2]3+ (apt = 3-aminopropanethiolate)". . p. 1041 - 1049. Retrieved 2006.
• 2、 Kennington, Stuart C.D.,Taylor, Adam J.,Romea, Pedro,Urpí, Fèlix,Aullón, Gabriel,Font-Bardia, Mercè,Ferré, Laura,Rodrigalvarez, Jesus. "Direct and Asymmetric Nickel(II)-Catalyzed Construction of Carbon-Carbon Bonds from N-Acyl Thiazinanethiones". . p. 305 - 309. Retrieved 2019.
• 3、 -. "N-ACYL AMINO ACID COMPOUNDS AND METHODS OF USE". Paragraph 0537. . Retrieved 2018/03/28.
• 4、 -. "PROTEIN KINASE D INHIBITORS". Page/Page column 51-52. . Retrieved 2012/06/30.