(1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid

Base Information

• Chemical Name: (1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid
• CAS No.: 127181-31-1
• Molecular Formula: C5H9NO3
• Molecular Weight: 131.13000
• Hs Code.: 2922500090
• DSSTox Substance ID: DTXSID20925807
• Nikkaji Number: J850.646I
• Mol file: 127181-31-1.mol

Synonyms:127181-31-1;(1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid;(1R,2S)-1-Amino-2-(hydroxymethyl)cyclopropanecarboxylic acid;(1R,2S)-1-AMINO-2-(HYDROXYMETHYL)CYCLOPROPANE-1-CARBOXYLIC ACID;Cyclopropanecarboxylic acid, 1-amino-2-(hydroxymethyl)-, (1R,2S)-;DTXSID20925807;ZPCQSJYTXRPREU-NQXXGFSBSA-N;MFCD07776897;AKOS017344536;1-Amino-2beta-(hydroxymethyl)cyclopropane-1alpha-carboxylic acid

Chemical Property of (1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid

Chemical Property:

• Vapor Pressure: 2.75E-05mmHg at 25°C
• Boiling Point: 319.6oC at 760 mmHg
• Flash Point: 147.1oC
• PSA: 83.55000
• Density: 1.455g/cm3
• LogP: -0.51900
• XLogP3: -3.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 131.058243149
• Heavy Atom Count: 9
• Complexity: 147

Purity/Quality:

98%min ^*data from raw suppliers

(1R,2S)-1-AMINO-2-(HYDROXYMETHYL)-CYCLOPROPANECARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C1(C(=O)O)N)CO
• Isomeric SMILES: C1[C@@H]([C@]1(C(=O)O)N)CO

Technology Process of (1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid

There total 48 articles about (1R,2S)-1-Amino-2-(hydroxymethyl)-cyclopropanecarboxylic acid 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: 100.0%

(1S,2R)-1-amino>-2-(hydroxymethyl)cyclopropanecarboxylic acid (127106-97-2) → (1S,2R)-1-amino-2-(hydroxymethyl)cyclopropanecarboxylic acid (125876-15-5,127181-31-1,146453-45-4,153610-74-3)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; for 24h; Ambient temperature;

DOI:10.1016/0957-4166(96)00038-9

Reference yield: 100.0%

(1R,2S)-(+)-1-N-tert-butoxycarbonylamino-2-hydroxymethylcyclopropanecarboxylic acid (127181-29-7) → (1R,2S)-1-amino-2-(hydroxymethyl)cyclopropanecarboxylic acid (127181-31-1,146453-45-4,153610-74-3)

Guidance literature:

With hydrogenchloride;

DOI:10.1016/S0957-4166(99)00463-2

Reference yield: 97.0%

(1R,3S,6S)-6-tert-butyl-1-hydroxymethyl-5-methoxy-6-methyl-7-oxa-4-azaspiro[2.5]oct-4-en-8-one (565237-65-2) → (1S,2R)-1-amino-2-(hydroxymethyl)cyclopropanecarboxylic acid (125876-15-5,127181-31-1,146453-45-4,153610-74-3)

Guidance literature:

(1R,3S,6S)-6-tert-butyl-1-hydroxymethyl-5-methoxy-6-methyl-7-oxa-4-azaspiro[2.5]oct-4-en-8-one; With trifluoroacetic acid; In water; acetonitrile; at 60 ℃; for 20h;

With sodium hydroxide; In methanol; water; at 60 ℃; for 20h;

DOI:10.1002/ejoc.200390179

upstream raw materials:

(1S,2R)-1-Amino-2-hydroxymethyl-cyclopropanecarboxylic acid methyl ester

(1S,2R)-1-amino>-2-(hydroxymethyl)cyclopropanecarboxylic acid

(1R,3S,6S)-6-tert-butyl-1-hydroxymethyl-5-methoxy-6-methyl-7-oxa-4-azaspiro[2.5]oct-4-en-8-one

methyl (1S,2R)-(-)-1-N-tert-butoxycarbonylamino-2-hydroxymethylcyclopropanecarboxylate