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112216

Sigma-Aldrich

4-Chlorobenzaldehyde

97%

Synonym(s):

p-Chlorobenzaldehyde

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About This Item

Linear Formula:
ClC6H4CHO
CAS Number:
104-88-1
Molecular Weight:
140.57
Beilstein:
385858
EC Number:
203-247-4
MDL number:
MFCD00003379
UNSPSC Code:
12352100
eCl@ss:
39050405
PubChem Substance ID:
24847077
NACRES:
NA.22

Quality Level

100

Assay

97%

form

solid

bp

213-214 °C (lit.)

mp

45-50 °C (lit.)

SMILES string

[H]C(=O)c1ccc(Cl)cc1

InChI

1S/C7H5ClO/c8-7-3-1-6(5-9)2-4-7/h1-5H

InChI key

AVPYQKSLYISFPO-UHFFFAOYSA-N

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General description

4-Chlorobenzaldehyde reacts with 3-tert-butyl-N-4-chlorobenzyl-1-phenyl-1H-pyrazol-5-amine to form (E)-3-tert-Butyl-4-(4-chlorobenzyl)-N-(4-chlorobenzylidene)-1-phenyl-1H-pyrazol-5-amine by a microwave-mediated reaction.

Pictograms

Exclamation markEnvironment
GHS07,GHS09

Signal Word

Warning

Hazard Statements

H302,H315,H317,H319,H411

Hazard Classifications

Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1

Storage Class Code

11 - Combustible Solids

WGK

WGK 2

Flash Point(F)

197.6 °F - closed cup

Flash Point(C)

92 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Jairo Quiroga et al.
Acta crystallographica. Section C, Crystal structure communications, 69(Pt 9), 1039-1042 (2013-09-06)
The title compound, C27H25Cl2N3, is an unexpected but high-yield product from the microwave-mediated reaction between 3-tert-butyl-N-4-chlorobenzyl-1-phenyl-1H-pyrazol-5-amine and 4-chlorobenzaldehyde. Inversion-related pairs of molecules are linked by C-H···π(arene) hydrogen bonds to form cyclic centrosymmetric dimers, and dimers of this type are linked
[Experimental substantiation of an approximate safe level of p-chlorobenzaldehyde in the air of the work area].
A I Khalepo et al.
Gigiena truda i professional'nye zabolevaniia, (2)(2), 50-51 (1987-02-01)
Mohammed M Rahman et al.
Designed monomers and polymers, 21(1), 82-98 (2018-05-31)
A new category of thermally stable hybrid polyarylidene(azomethine-ether)s and copolyarylidene(azomethine-ether)s (PAAP) based on diarylidenecycloalkanones has been synthesized using solution polycondensation method. For potential cationic sensor development, a thin layer of PAAP onto a flat glassy carbon electrode (GCE, surface area:
M Reza Naimi-Jamal et al.
Molecular diversity, 14(3), 473-477 (2010-04-08)
Solvent-free one-pot synthesis of 2-amino-4H-chromene scaffold is described in a very simple, efficient, and environmentally benign method using sodium carbonate as a cheap and non-toxic catalyst with up to excellent yields.
Divya P Narayanan et al.
Journal of colloid and interface science, 520, 70-80 (2018-03-13)
A one pot synthesis of carbon dot incorporated porous coconut shell char derived sulphonated catalyst is reported here for the first time and is effectively used in the multicomponent synthesis of amidoalkyl naphthol. Macroporous nature of the char is revealed
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