Butanal, (2,4-dinitrophenyl)hydrazone

Base Information

• Chemical Name: Butanal, (2,4-dinitrophenyl)hydrazone
• CAS No.: 1527-98-6
• Molecular Formula: C10H12 N4 O4
• Molecular Weight: 252.23
• Hs Code.: 2928000090
• European Community (EC) Number: 625-638-2
• NSC Number: 404127
• Mol file: 1527-98-6.mol

Synonyms:1527-98-6;N-Butyraldehyde 2,4-dinitrophenylhydrazone;1-Butylidene-2-(2,4-dinitrophenyl)hydrazine;Butyraldehyde-2,4-dinitrophenylhydrazone;Butanal, (2,4-dinitrophenyl)hydrazone;Butyraldehyde, (2,4-dinitrophenyl)hydrazone;259824-54-9;Butyraldehyde-2,4-DNPH;MFCD00191327;NSC404127;(1E)-Butanal (2,4-dinitrophenyl)hydrazone #;SCHEMBL22261597;Butanal,4-dinitrophenyl)hydrazone;IKGRHEWIFBFXPP-IZZDOVSWSA-N;BAA52798;AKOS024258411;Butyraldehyde,4-dinitrophenyl)hydrazone;NSC-404127;Butyraldehyde 2?4-Dinitrophenylhydrazone;Butyraldehyde-2,4-DNPH, analytical standard;BUTANAL,2-(2,4-DINITROPHENYL)HYDRAZONE;Butyraldehyde-2,4-DNPH, certified reference material, TraceCERT(R)

Chemical Property of Butanal, (2,4-dinitrophenyl)hydrazone

Chemical Property:

• Appearance/Colour: ORANGE FIBERS, POWDER OR CRYSTALS
• Vapor Pressure: 1.15E-06mmHg at 25°C
• Melting Point: 117-119 °C(lit.)
• Boiling Point: 401.8 °C at 760 mmHg
• PKA: 12.29±0.10(Predicted)
• Flash Point: 196.8 °C
• PSA: 116.03000
• Density: 1.36 g/cm³
• LogP: 3.82020
• Storage Temp.: 0-6°C
• Solubility.: DMSO, Methanol (Sparingly)
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 252.08585488
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

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

Butyraldehyde 2,4-Dinitrophenylhydrazone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): XnXiF
• Hazard Codes: Xi,Xn,F
• Statements: 36/37/38-36-20/21/22-11
• Safety Statements: 26-36/37-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
• Isomeric SMILES: CCC/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
• Uses: Butyraldehyde 2,4-Dinitrophenylhydrazone is a dinitrophenylhydrazone (DNPH) derivative of an aliphatic aldehyde found in mainstream cigarette smoke.

Technology Process of Butanal, (2,4-dinitrophenyl)hydrazone

There total 8 articles about Butanal, (2,4-dinitrophenyl)hydrazone 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: 89.0%

C17H30OSSi + (2,4-dinitro-phenyl)-hydrazine (119-26-6) → 2,4-Dinitrophenylhydrazone of n-butanal (1527-98-6)

Guidance literature:

C₁₇H₃₀OSSi; With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at -78 ℃; for 3h; Inert atmosphere;

(2,4-dinitro-phenyl)-hydrazine; With sulfuric acid; In ethanol; dichloromethane; water; at -78 - 21 ℃; for 1h; Inert atmosphere;

DOI:10.1021/acs.orglett.1c01149

Reference yield:

butyraldehyde (123-72-8) + (2,4-dinitro-phenyl)-hydrazine (119-26-6) → 2,4-Dinitrophenylhydrazone of n-butanal (1527-98-6)

Guidance literature:

phosphoric acid; In toluene; butan-1-ol; at 20 ℃; Rate constant;

Reference yield:

2-(n-propyl)-1,3-dithiane (42196-80-5) + (2,4-dinitro-phenyl)-hydrazine (119-26-6) → 2,4-Dinitrophenylhydrazone of n-butanal (1527-98-6)

Guidance literature:

2-(n-propyl)-1,3-dithiane; With dihydrogen peroxide; iodine; sodium dodecyl-sulfate; In water; at 20 ℃; for 1.5h; Micellar solution;

(2,4-dinitro-phenyl)-hydrazine; With sulfuric acid; In methanol; at 20 ℃; for 0.5h;

DOI:10.1055/s-0028-1088023

upstream raw materials:

Butyraldehyd-(ethyl-butyl-hydrazon)

(2,4-dinitro-phenyl)-hydrazine

N-[1-((1-cyano-2-methylpropyl)hydroxyamino)butyl]formamide

butyraldehyde

Downstream raw materials:

butyryl bromide 2,4-dinitrophenylhydrazone

N-(2,4-dinitrophenyl)-C-n-propylhydrazonyl chloride

1-(2,4-Dinitro-phenyl)-5-methyl-3-propyl-1H-[1,2,4]triazole

Refernces

• 1、 Ghosh, Aniruddha,Saha, Rumpa,Saha, Bidyut. "Effect of CHAPS and CPC micelles on Ir(III) catalyzed Ce(IV) oxidation of aliphatic alcohols at room temperature and pressure". . p. 223 - 237. Retrieved 2014/05/06.
• 2、 Mathew, Sindhu,Grey, Carl,Rumpunen, Kimmo,Adlercreutz, Patrick. "Analysis of carbonyl compounds in sea buckthorn for the evaluation of triglyceride oxidation, by enzymatic hydrolysis and derivatisation methodology". experimental part. p. 1399 - 1405. Retrieved 2012/02/03.