Butanal, 3-methyl-, oxime, (Z)-

Base Information

• Chemical Name: Butanal, 3-methyl-, oxime, (Z)-
• CAS No.: 5780-40-5
• Molecular Formula: C₅H₁₁NO
• Molecular Weight: 101.148
• NSC Number: 75629
• Nikkaji Number: J134.731D,J3.620.519I
• Wikidata: Q27154959
• Mol file: 5780-40-5.mol

Synonyms:Butanal, 3-methyl-, oxime, (Z)-;5780-40-5;(E)-N-(3-methylbutylidene)hydroxylamine;(E)-3-Methylbutyraldehyde oxime;Isovaleraldoxime;z-isovaleraldoxime;isovaleraldehyde oxime;(NZ)-N-(3-methylbutylidene)hydroxylamine;(Z)-3-methylbutanal oxime;(1Z)-3-Methylbutanal oxime #;SCHEMBL10595937;JAUPRNSQRRCCRR-XQRVVYSFSA-N;Butyl aldoxime, 3-methyl-, syn-;NSC75629;NSC-75629;J3.620.519I;Q27154959

Chemical Property of Butanal, 3-methyl-, oxime, (Z)-

Chemical Property:

• Boiling Point: 158°Cat760mmHg
• PKA: 12.10±0.10(Predicted)
• Flash Point: 71.4°C
• PSA: 32.59000
• Density: 0.89g/cm³
• LogP: 1.49250
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 101.084063974
• Heavy Atom Count: 7
• Complexity: 59.1

Purity/Quality:

99%min ^*data from raw suppliers

(Z)-3-METHYL OXIME BUTANAL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC=NO
• Isomeric SMILES: CC(C)C/C=N\O

Technology Process of Butanal, 3-methyl-, oxime, (Z)-

There total 1 articles about Butanal, 3-methyl-, oxime, (Z)- 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:

isovaleraldehyde (590-86-3) → (Z)-3-methylbutanal oxime (5780-40-5) + 3-methyl-butyraldehyde oxime (5775-74-6)

Guidance literature:

With hydroxylamine hydrochloride; water; sodium carbonate;

upstream raw materials:

isovaleraldehyde

Refernces

• 1、 Pedras, M. Soledade C.,Minic, Zoran,Thongbam, Premila D.,Bhaskar, Vangala,Montaut, Sabine. "Indolyl-3-acetaldoxime dehydratase from the phytopathogenic fungus Sclerotinia sclerotiorum: Purification, characterization, and substrate specificity". experimental part. p. 1952 - 1962. Retrieved 2011/06/26.