N-BENZYLHYDROXYLAMINE HYDROCHLORIDE

Base Information

• Chemical Name: N-BENZYLHYDROXYLAMINE HYDROCHLORIDE
• CAS No.: 622-30-0
• Molecular Formula: C7H9NO
• Molecular Weight: 123.155
• Hs Code.: 2928000090
• DSSTox Substance ID: DTXSID80383181
• Nikkaji Number: J95.591D
• Wikidata: Q72441286
• ChEMBL ID: CHEMBL1441489
• Mol file: 622-30-0.mol

Synonyms:Hydroxylamine,N-benzyl- (6CI,7CI,8CI);Benzylhydroxylamine;N-Benzylhydroxylamine;N-Hydroxybenzylamine;O-Benzylhydroxyamine;

Chemical Property of N-BENZYLHYDROXYLAMINE HYDROCHLORIDE

Chemical Property:

• Vapor Pressure: 0.00923mmHg at 25°C
• Melting Point: ~105 °C
• Refractive Index: 1.561
• Boiling Point: 253.9 °C at 760 mmHg
• PKA: 13.19±0.30(Predicted)
• Flash Point: 135.2 °C
• PSA: 32.26000
• Density: 1.098g/cm³
• LogP: 1.55630
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 123.068413911
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99%, ^*data from raw suppliers

N-Benzylhydroxylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CNO

Technology Process of N-BENZYLHYDROXYLAMINE HYDROCHLORIDE

There total 65 articles about N-BENZYLHYDROXYLAMINE HYDROCHLORIDE 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%

N-benzylhydroxylamine hydrochloride (29601-98-7) → N-benzyl hydroxylalmine (622-30-0)

Guidance literature:

With sodium hydrogencarbonate; In water;

Reference yield: 100.0%

Benzaldoxime (932-90-1) → N-benzyl hydroxylalmine (622-30-0)

Guidance literature:

With K₁₂(Ga₄(1,5-bis(2,3-dihydroxybenzamido)naphthalene))6; potassium phosphate; borane pyridine; In water-d2; at 20 ℃; for 22h; Reagent/catalyst; Inert atmosphere; Sealed tube;

DOI:10.1021/jacs.0c12479

Reference yield: 94.0%

syn-benzaldehyde oxime (932-90-1,622-31-1,140461-24-1,140461-25-2,622-32-2) → N-benzyl hydroxylalmine (622-30-0)

Guidance literature:

With sodium cyanoborohydride; acetyl chloride; In methanol; at 0 ℃;

DOI:10.1021/ja00241a025

upstream raw materials:

N,O-dibenzylhydroxylamine

N-benzyl-O-benzoylhydroxylamine

sodium ethanolate

N-Benzylidenebenzylamine N-oxide

Downstream raw materials:

(Z)-N-(furan-2-ylmethylene)-1-phenylmethanamine oxide

4-methyl-benzaldehyde-(N-benzyl oxime )

N-benzyl-C-o-chlorophenyl nitrone

N,N-dibenzylhydroxylamine

Refernces

A mild approach to the synthesis of 4-amino-8-(arylamino)pyrimido[5,4-d] pyrimidine 3-oxides

10.1002/ejoc.200900216

The research presents a novel and efficient method for synthesizing pyrimido[5,4-d]pyrimidine N-oxides, which are of significant interest in drug development due to their structural similarity to purines and their potential biological activities. The study explores the reaction of benzylhydroxylamine with 6-cyanopurines to form 7-benzyloxy-8-imino-7,8-dihydropyrimido[5,4-d]pyrimidines, which upon treatment with hydrochloric acid, yield the desired N-oxides. The study concludes that the solubility of the hydrochloride of the intermediate pyrimido-pyrimidines in the reaction solvent plays a crucial role in determining the final product, with soluble hydrochlorides leading to the rearranged product and insoluble ones yielding the N-oxides. This work provides a mild and selective approach to synthesizing these heterocyclic compounds, which could have implications for the development of new pharmaceutical agents.

A Novel Method for the Preparation of Primary Amines by the Use of N-Benzylhydroxylamine and 2-Fluoropyridinium Salt

10.1246/cl.1978.1057

The study presents a novel method for the preparation of primary amines using N-benzylhydroxylamine and 2-fluoropyridinium salt. N-benzylhydroxylamine serves as a synthetic intermediate with two functional groups (an amino group and a hydroxyl group), which is alkylated by alkyl halides or olefinic compounds to form N-alkyl-N-benzylhydroxylamine. This intermediate is then dehydrated using 2-fluoropyridinium salt and triethylamine to yield N-benzylidenealkylamine, which is subsequently hydrolyzed in dilute hydrochloric acid to produce the desired primary amine. The method involves three key reactions: N-alkylation of N-benzylhydroxylamine, dehydration using the 2-fluoropyridinium salt, and acid hydrolysis of the resulting imine. The study demonstrates the effectiveness of this approach through the synthesis of various primary amines, achieving good yields and highlighting the utility of the reagents and reaction conditions employed.

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 622-30-0 N-BENZYLHYDROXYLAMINE HYDROCHLORIDE

Send

Send

Metric Ton KG G Pound L ML

Send

Send