N-Benzylhydroxylamine hydrochloride

Base Information

• Chemical Name: N-Benzylhydroxylamine hydrochloride
• CAS No.: 29601-98-7
• Molecular Formula: C7H10ClNO
• Molecular Weight: 159.615
• Hs Code.: 29280000
• European Community (EC) Number: 629-276-6
• DSSTox Substance ID: DTXSID30462571
• Mol file: 29601-98-7.mol

Synonyms:N-Benzylhydroxylamine hydrochloride;29601-98-7;N-Benzylhydroxylamine HCl;N-benzyl-hydroxylamine hydrochloride;N-benzylhydroxylamine;hydrochloride;N-hydroxybenzylamine hydrochloride;hydron;chloride;Benzenemethanamine, N-hydroxy-, hydrochloride (1:1);MFCD00043377;N-Benzylhydroxylamine (hydrochloride);N-Benzylhydroxyamine hydrochloride;Benzenemethanamine, N-hydroxy-, hydrochloride;N-benzyl-N-hydroxylamine hydrochloride;Ticagrelor Intermediates;SCHEMBL359448;N-Benzylhydroxylamne hydrochlorde;DTXSID30462571;YSNXOQGDHGUKCZ-UHFFFAOYSA-N;BCP07876;N-benzyl hydroxylamine hydrochloride;AKOS015889866;CS-W002216;GS-3832;HY-W002216;SB36439;N-Benzylhydroxylamine hydrochloride, 95%;N-Benzylhydroxylamine hydrochloride, 97%;SY019534;AM20120645;B4073;FT-0689244;EN300-123434;J-017577;J-523481;N-Benzylhydroxylamine hydrochloride, puriss., >=99.0% (AT)

Chemical Property of N-Benzylhydroxylamine hydrochloride

Chemical Property:

• Melting Point: 108-110 °C(lit.)
• Boiling Point: 253.9 °C at 760 mmHg
• Flash Point: 135.2 °C
• PSA: 32.26000
• LogP: 2.35830
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 159.0450916
• Heavy Atom Count: 10
• Complexity: 69.3

Purity/Quality:

99% ^*data from raw suppliers

N-HydroxybenzylamineHydrochloride ^*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.Cl
• Uses: N-Benzylhydroxylamine hydrochloride may be used in the preparation of a precursor to hitherto unknown aminocyclopentitol derivative, hydroxy functionalised 4-exo-ethoxycarbonyl-3-oxa-2-azabicyclo[3.3.0]octane system.

Technology Process of N-Benzylhydroxylamine hydrochloride

There total 20 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: 96.0%

N-Benzylidenebenzylamine N-oxide (3376-26-9) → N-benzylhydroxylamine hydrochloride (29601-98-7) + Benzaldoxime (932-90-1)

Guidance literature:

With hydroxylamine hydrochloride; In methanol; diethyl ether; at 20 ℃; for 4h;

DOI:10.1080/00397910500191169

Reference yield: 87.3%

N-Benzylidenebenzylamine N-oxide (3376-26-9) → N-benzylhydroxylamine hydrochloride (29601-98-7)

Guidance literature:

With hydroxylamine hydrochloride; In ethanol; tert-butyl methyl ether; at 35 ℃; for 3h;

Reference yield: 69.0%

Benzaldoxime (932-90-1) → N-benzylhydroxylamine hydrochloride (29601-98-7)

Guidance literature:

Benzaldoxime; With hydrogenchloride; methanol; sodium cyanoborohydride; In water; for 3.75h;

With hydrogenchloride; In diethyl ether;

DOI:10.1021/acs.orglett.7b00358

upstream raw materials:

N-benzyl hydroxylalmine

N-benzylbenzohydroxamic acid

N-Benzyl-p-fluorobenzohydroxamic acid

N-benzyl-N-hydroxy-4-nitrobenzamide

Downstream raw materials:

N-benzylsulfamic acid

α,α-azodioxytoluene

N-benzyl-N-nitroso-hydroxylamine

N-Benzylidenebenzylamine N-oxide

Refernces

• 1、 Ortiz, Gerardo X.,Hemric, Brett N.,Wang, Qiu. "Direct and Selective 3-Amidation of Indoles Using Electrophilic N-[(Benzenesulfonyl)oxy]amides". supporting information. p. 1314 - 1317. Retrieved 2017/03/23.
• 2、 Nguyen, Thanh Binh,Martel, Arnaud,Dhal, Robert,Dujardin, Gilles. "A large-scale low-cost preparation of n-benzylhydroxylamine hydrochloride". experimental part. p. 3174 - 3176. Retrieved 2009/12/29.