Tert-butyl hydroxy(methyl)carbamate

Base Information

• Chemical Name: Tert-butyl hydroxy(methyl)carbamate
• CAS No.: 19689-97-5
• Molecular Formula: C6H13 N O3
• Molecular Weight: 147.174
• European Community (EC) Number: 860-166-2
• NSC Number: 116783
• DSSTox Substance ID: DTXSID20297596
• Nikkaji Number: J2.259.665I
• Wikidata: Q82038777
• Mol file: 19689-97-5.mol

Synonyms:tert-butyl hydroxy(methyl)carbamate;19689-97-5;tert-butyl N-hydroxy-N-methylcarbamate;C6H13NO3;NSC116783;N-Boc-N-methylhydroxylamine;N-methyl-N-boc hydroxylamine;SCHEMBL28394;N-Boc-N-methyl hydroxylamine;DTXSID20297596;tert-butylhydroxy(methyl)carbamate;BFTVWTYYQWTLQL-UHFFFAOYSA-N;MFCD24465554;NSC-116783;BS-15869;N-t-butoxycarbonyl-N-methyl hydroxylamine;CS-0160278;FT-0755029;N-(tert-butoxycarbonyl)-N-methylhydroxylamine;D71132;EN300-310250;TERT-BUTYL N-HYDROXY-N-METHYL-CARBAMATE;A925128;A1-08147

Chemical Property of Tert-butyl hydroxy(methyl)carbamate

Chemical Property:

• Vapor Pressure: 0.128mmHg at 25°C
• Refractive Index: 1.454
• Boiling Point: 192.7°Cat760mmHg
• Flash Point: 70.3°C
• Density: 1.083g/cm³
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 147.08954328
• Heavy Atom Count: 10
• Complexity: 127

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N(C)O

Technology Process of Tert-butyl hydroxy(methyl)carbamate

There total 7 articles about Tert-butyl hydroxy(methyl)carbamate 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: 99.0%

di-tert-butyl dicarbonate (24424-99-5) + N-methylhydroxyamine hydrochloride (4229-44-1) → N-(tert-butoxycarbonyl)-N-methylhydroxylamine (19689-97-5)

Guidance literature:

With sodium hydrogencarbonate; In tetrahydrofuran; water; at 20 ℃;

DOI:10.1021/ja406181e

Reference yield: 92.0%

N-Methylhydroxylamine (593-77-1) + di-tert-butyl dicarbonate (24424-99-5) → N-(tert-butoxycarbonyl)-N-methylhydroxylamine (19689-97-5)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃;

DOI:10.1039/d1ob00941a

Reference yield: 85.0%

tert-Butyl-carbamic acid tert-butyl ester (71872-03-2) + N-methylhydroxyamine hydrochloride (4229-44-1) → N-(tert-butoxycarbonyl)-N-methylhydroxylamine (19689-97-5)

Guidance literature:

With triethylamine; In dichloromethane; for 4h;

DOI:10.1021/jo026641p

upstream raw materials:

tert-Butyl N-hydroxycarbamate

methyl iodide

N-Methylhydroxylamine

di-tert-butyl dicarbonate

Downstream raw materials:

tert-butyl (2,4-dinitrophenoxy)(methyl)carbamate

O-mesitylenesulfonyl-N-tert-butoxycarbonyl-N-methylhydroxylamine

2-(N-t-butyloxycarbonyl-N-methylamino)phenol

2-(N-t-butyloxycarbonyl-N-methylamino)-5-methylphenol