O-butylhydroxylamine hydrochloride

Base Information

• Chemical Name: O-butylhydroxylamine hydrochloride
• CAS No.: 4490-82-8
• Molecular Formula: C4H11NO.ClH
• Molecular Weight: 125.598
• Hs Code.: 2922199090
• European Community (EC) Number: 831-538-1
• DSSTox Substance ID: DTXSID90484274
• Mol file: 4490-82-8.mol

Synonyms:O-butylhydroxylamine hydrochloride;4490-82-8;O-BUTYLHYDROXYLAMINE HCL;O-butylhydroxylamine;hydrochloride;MFCD00487631;O-Butyl-Hydroxylamine;Hydroxylamine, O-butyl-, hydrochloride;O-ButylhydroxylamineHydrochloride;butoxylamine hydrochloride;n-butoxyamine hydrochloride;SCHEMBL242691;DTXSID90484274;HUYRNQWVAPCTQZ-UHFFFAOYSA-N;O-n-butyl-hydroxylamine hydrochloride;AKOS022184155;AS-17987;SY019069;O-butylhydroxylamine pound nothydrochloride;B5686;CS-0106180;FT-0768495;EN300-211436

Chemical Property of O-butylhydroxylamine hydrochloride

Chemical Property:

• Melting Point: 157.0 to 161.0 °C
• PSA: 35.25000
• LogP: 2.17910
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Solubility.: soluble in Methanol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 125.0607417
• Heavy Atom Count: 7
• Complexity: 23.5

Purity/Quality:

98%,99%, ^*data from raw suppliers

O-Butylhydroxylamine Hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCON.Cl

Technology Process of O-butylhydroxylamine hydrochloride

There total 7 articles about O-butylhydroxylamine 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%

2-butoxyisoindoline-1,3-dione (51951-28-1) → butoxyamine hydrochloride (4490-82-8)

Guidance literature:

2-butoxyisoindoline-1,3-dione; With methylhydrazine; In dichloromethane; at 0 - 20 ℃; for 2h;

With hydrogenchloride; In 1,4-dioxane; at 0 ℃;

Reference yield: 97.0%

C8H17NO2 (60302-19-4) → butoxyamine hydrochloride (4490-82-8)

Guidance literature:

With hydrogenchloride; water; In isopropyl alcohol; at 20 ℃;

DOI:10.1007/s00726-009-0410-0

Reference yield: 69.0%

N-benzoyl-O-butylhydroxylamine (23362-50-7) → butoxyamine hydrochloride (4490-82-8)

Guidance literature:

With hydrogenchloride; In ethanol; for 0.75h; Heating;

DOI:10.1016/j.mrgentox.2006.02.003

upstream raw materials:

2-butoxyisoindoline-1,3-dione

N-benzoyl-O-butylhydroxylamine

O-n-butylhydroxylamine

C₈H₁₇NO₂

Downstream raw materials:

N-benzoyl-O-butylhydroxylamine

(E)-3-(1-(butoxyamino)ethylidene)-1-cyclohexylpyrrolidine-2,4-dione

Refernces

• 1、 -. "Sterol derivatives and its preparation method and application". Paragraph 0097-0099. . Retrieved 2019/05/19.
• 2、 Kim, Taelim,Kim, Hye-In,An, Ji-Young,Lee, Jun,Lee, Na-Rae,Heo, Jinyuk,Kim, Ji-Eun,Yu, Jihyun,Lee, Yong Sup,Inn, Kyung-Soo,Kim, Nam-Jung. "Identification of novel estrogen receptor (ER) agonists that have additional and complementary anti-cancer activities via ER-independent mechanism". supporting information. p. 1844 - 1848. Retrieved 2016/07/27.