Basic information Safety Supplier Related
ChemicalBook >  Product Catalog >  Chemical Reagents >  Organic reagents >  Acyl halide >  4-Cyanobenzoyl chloride

4-Cyanobenzoyl chloride

Basic information Safety Supplier Related

4-Cyanobenzoyl chloride Basic information

Product Name:
4-Cyanobenzoyl chloride
Synonyms:
  • 4-CYANOBENZOYL CHLORIDE
  • LABOTEST-BB LTBB000677
  • P-CYANOBENZOYL CHLORIDE
  • 4-Cyanocbenzoyl chloride
  • 4-Cyanobenzoyl chloride 98%
  • 4-Cyanobenzoyl chloride ,97%
  • 4-cyanobenzoic chloride
  • 4-Cyanobenzenecarbonyl chloride
CAS:
6068-72-0
MF:
C8H4ClNO
MW:
165.58
EINECS:
228-005-5
Product Categories:
  • Absolute Configuration Determination (Exciton Chirality CD Method)
  • Analytical Chemistry
  • Benzonitriles (Building Blocks for Liquid Crystals)
  • Building Blocks for Liquid Crystals
  • Enantiomer Excess & Absolute Configuration Determination
  • Exciton Chirality CD Method (for Hydroxyl Groups)
  • Aromatic Halides (substituted)
  • Functional Materials
  • Acid Halides
  • Carbonyl Compounds
  • Organic Building Blocks
Mol File:
6068-72-0.mol
More
Less

4-Cyanobenzoyl chloride Chemical Properties

Melting point:
68-70 °C(lit.)
Boiling point:
110 °C / 2mmHg
Density 
1.2744 (rough estimate)
refractive index 
1.5430 (estimate)
storage temp. 
Inert atmosphere,Room Temperature
form 
Crystalline Powder
color 
Almost white to beige
Water Solubility 
Reacts with water.
Sensitive 
Moisture Sensitive
BRN 
386729
InChIKey
USEDMAWWQDFMFY-UHFFFAOYSA-N
CAS DataBase Reference
6068-72-0(CAS DataBase Reference)
More
Less

Safety Information

Hazard Codes 
C
Risk Statements 
34
Safety Statements 
26-36/37/39-45-24/25
RIDADR 
UN 3261 8/PG 2
WGK Germany 
3
10-21
Hazard Note 
Irritant
HazardClass 
8
PackingGroup 
II
HS Code 
29269090

MSDS

More
Less

4-Cyanobenzoyl chloride Usage And Synthesis

Chemical Properties

almost white to beige crystalline powder

Uses

4-Cyanobenzoyl chloride has been used in the synthesis of new liquid crystalline heteroaromatic compounds containing the five-membered isoxazole, tetrazole and 1,2,4-oxadiazole rings. It has been used in the synthesis of substituted benzoate esters and to study their excited-state behavior.

Definition

ChEBI: 4-cyanobenzoyl chloride is an acyl chloride consisting of benzoyl chloride in which the hydrogen at position 4 is replaced by a cyano group. It is a nitrile, a member of benzenes and an acyl chloride. It is functionally related to a benzoyl chloride.

General Description

4-Cyanobenzoyl chloride participates in the benzylamine acylation of Argopore MB-CHO resin in the presence of pyridine and catalyst. It reacts with 4-hydroxy-2,2,6,6-tetramethyl-1-piperidinoxyl (4-hydroxy-TEMPO) in pyridine under nitrogen atmosphere to form 4-cyanobenzoyl-TEMPO.

Purification Methods

If the IR shows the presence of OH, then treat it with SOCl2 boil for 1hour, evaporate and distil it in a vacuum. The distillate solidifies and can be recrystallised from pet ether. It is moisture sensitive and an IRRITANT. [Ashley et al. J Chem Soc 103 1942, Fison et al. J Org Chem 16 648 1951,[Beilstein 9 III 4255, 14 IV 3327.]

4-Cyanobenzoyl chloride Preparation Products And Raw materials

Raw materials

4-Cyanobenzoyl chlorideSupplier

Chengdu RunZeBenTu Chemical Co., Ltd Gold
Tel
028-88469284 18000562381
Email
rzbtsj@163.com
Qi-Chem Co., Ltd. Gold
Tel
0411-88165951 13601035838
Email
marketing@qi-chem.com
BEIJING ODYSSEY CHEMICALS CO.,LTD Gold
Tel
010-88018188-305 13601004222
Email
maxma@bj-odyssey.com
BEIJING ODYSSEY CHEMICALS CO.,LTD Gold
Tel
10-88018188-315 17502279376
Email
kallisto@bj-odyssey.com
Hebei Yanxi Chemical Co., Ltd. Gold
Tel
0311-66561638 17531153977