Welcome to LookChem.com Sign In|Join Free

CAS

  • or

4996-21-8

Post Buying Request

4996-21-8 Suppliers

Recommended suppliersmore

  • Product
  • FOB Price
  • Min.Order
  • Supply Ability
  • Supplier
  • Contact Supplier

4996-21-8 Usage

General Description

4-Chlorophenylglyoxal hydrate is a chemical compound with the molecular formula C8H7ClO3. It is a hydrate form of 4-chlorophenylglyoxal, a chlorinated derivative of phenylglyoxal. 4-Chlorophenylglyoxal hydrate is mainly used as a reactant in organic synthesis, particularly in the preparation of various pharmaceutical intermediates. It is a key starting material for the synthesis of many biologically active compounds, including antifungal agents, antibacterials, antihypertensive drugs, and other pharmaceuticals. Additionally, 4-chlorophenylglyoxal hydrate is also utilized as a building block in the production of dyes and pigments. Due to its versatile applications, this chemical compound is of significant interest to researchers and manufacturers in the pharmaceutical and chemical industries.

Check Digit Verification of cas no

The CAS Registry Mumber 4996-21-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,9,9 and 6 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 4996-21:
(6*4)+(5*9)+(4*9)+(3*6)+(2*2)+(1*1)=128
128 % 10 = 8
So 4996-21-8 is a valid CAS Registry Number.
InChI:InChI=1/C8H5ClO2.H2O/c9-7-3-1-6(2-4-7)8(11)5-10;/h1-5H;1H2

4996-21-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-Chlorophenylglyoxal hydrate

1.2 Other means of identification

Product number -
Other names 4'-chloro-2,2-dihydroxyacetophenone

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:4996-21-8 SDS

4996-21-8Synthetic route

para-chloroacetophenone
99-91-2

para-chloroacetophenone

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

Conditions
ConditionsYield
With selenium(IV) oxide In 1,4-dioxane; water at 100℃; for 0.25h; Microwave irradiation;80%
Stage #1: para-chloroacetophenone With selenium(IV) oxide; water In 1,4-dioxane for 7h; Reflux;
Stage #2: With water for 4h; Reflux;
69%
With hydrogen bromide In water; dimethyl sulfoxide at 55℃;52%
4-chlorobenzoylmethyl bromide
536-38-9

4-chlorobenzoylmethyl bromide

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

Conditions
ConditionsYield
With water; hydrogen bromide In dimethyl sulfoxide at 80℃; for 5h;70%
4-chlorophenylglyoxal
4998-15-6

4-chlorophenylglyoxal

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

Conditions
ConditionsYield
With water Reflux;
With water Reflux;
With water Reflux;
diazoacetic acid ethyl ester
623-73-4

diazoacetic acid ethyl ester

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

4-methoxy-aniline
104-94-9

4-methoxy-aniline

ethyl (2R,3S)-3-(4-chlorobenzoyl)-1-(4-methoxyphenyl)aziridine-2-carboxylate
1153714-79-4

ethyl (2R,3S)-3-(4-chlorobenzoyl)-1-(4-methoxyphenyl)aziridine-2-carboxylate

Conditions
ConditionsYield
Stage #1: 1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone; 4-methoxy-aniline With (R)-3,3'-bis(tris(4-tert-butylphenyl)silyl)-1,1'-binaphthyl-2,2'-diyl hydrogenphosphate In toluene at 20℃; for 1h;
Stage #2: diazoacetic acid ethyl ester In toluene at -30℃; for 23h; aza-Darzens reaction; optical yield given as %ee; enantioselective reaction;
100%
N-hydroxyurea
127-07-1

N-hydroxyurea

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

5-(4-chlorophenyl)-3-hydroxyimidazolidine-2,4-dione
1118067-55-2

5-(4-chlorophenyl)-3-hydroxyimidazolidine-2,4-dione

Conditions
ConditionsYield
Stage #1: N-hydroxyurea; 1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone In acetonitrile at 20℃; for 51h;
Stage #2: In acetonitrile Reflux;
100%
With acetic acid at 18 - 19℃; for 24h;69%
2,4-dimethyl-3-pentanol
600-36-2

2,4-dimethyl-3-pentanol

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone
4996-21-8

1-(4-chloro-phenyl)-2,2-dihydroxy-ethanone

C15H21ClO3

C15H21ClO3

Conditions
ConditionsYield
With C23H39N3O3; copper(II) bis(trifluoromethanesulfonate) In dichloromethane at 20℃; for 3h; Cannizzaro Reaction; Inert atmosphere; Molecular sieve; Schlenk technique; enantioselective reaction;99%

4996-21-8Relevant articles and documents

One-pot, three-component synthesis of polyfunctionalized benzo[h]pyrazolo[3,4-b][1,6]naphthyridine and benzo[g]pyrazolo[3,4-b]quinoline derivatives in the presence of silver nanoparticles (AgNPs)

Khalafy, Jabbar,Majidi Arlan, Fatemeh,Poursattar Marjani, Ahmad,Sarchami, Vahid

, p. 3961 - 3969 (2020/09/01)

An efficient and straightforward protocol for one-pot, three-component reaction of aryl glyoxal monohydrates 1a-h, 5-amino-1-aryl-3-methylpyrazoles 2a,b and 4-hydroxyquinoline-2(1H)-one (3) or 2-hydroxy-1,4-naphthoquinone (4) using silver nanoparticles (AgNPs) as a high performance nanocatalyst in H2O/EtOH at 60°C afforded the corresponding polyfunctionalized benzo[h]pyrazolo[3,4-b][1,6]naphthyridines 5a-h and benzo[g]pyrazolo[3,4-b]quinolines 6a-i, respectively. Excellent catalytic activity, high yields, employing green media and green nanocatalyst, cost-effective and simple procedure are some notable advantages of using AgNPs as a noble metal nanocatalyst in this synthetic strategy. The structures of fused heterocycles were confirmed by their Fourier transform infrared, proton nuclear magnetic resonance (1H-NMR), and 13C-NMR spectral data and microanalysis.

Synthesis of Ethyl 2-Amino-4-benzoyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carboxylates by a One-pot, Three-Component Reaction in the Presence of TPAB

Poursattar Marjani, Ahmad,Khalafy, Jabbar,Farajollahi, Ayda

, p. 268 - 274 (2018/11/30)

In this research, in order to synthesize a series of ethyl 2-amino-4-benzoyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]quinoline-3-carboxylates, a green and an efficient method is proposed through one-pot three-component reaction of substituted arylglyoxals, ethyl cyanoacetate, and 4-hydroxyquinolin-2(1H)-one in the presence of terapropylammonium bromide as a catalyst in good yields. All synthesized new substances were characterized by FTIR, 1H-NMR, and 13C-NMR spectral data and elemental analysis.

Synthesis of 4-Hydroxy-3-(2-arylimidazo[1,2-a]pyridin-3-yl)quinolin-2(1H)-ones in the Presence of DABCO as an Efficient Organocatalyst

Khalafy, Jabbar,Etivand, Nasser,Poursattar Marjani, Ahmad,Khalillou, Neda

, p. 1857 - 1865 (2019/05/21)

The one-pot, three-component, synthesis of a new series of 4-hydroxy-3-(2-arylimidazo[1,2-a]pyridin-3-yl)quinolin-2(1H)-ones in the presence of DABCO as a catalyst has been achieved using aryl glyoxal monohydrates, quinoline-2,4(1H,3H)-dione, and 2-aminopyridine in H2O/EtOH under reflux conditions. The cheapness of organocatalyst, simple workup, operational simplicity, regioselectivity, and high yields are some advantages of this protocol.

Post a RFQ

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)

1

What can I do for you?
Get Best Price

Get Best Price for 4996-21-8