4-Cyanobenzoyl chloride

ALDRICH/124826 - 98%

Synonym: 4-Cyanobenzoic acid chloride; p-Cyanobenzoyl chloride

CAS Number: 6068-72-0
Empirical Formula (Hill Notation): C₈H₄ClNO
Molecular Weight: 165.58
EC Number: 228-005-5
MDL Number: MFCD00001822
Linear Formula: NCC₆H₄COCl
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-124826-1G	1 g	$0.00 1/EA CALL FOR PRICEAdd To Favorites		Add To Favorites
45-124826-5G	5 g	$0.00 1/EA CALL FOR PRICEAdd To Favorites		Add To Favorites
45-124826-25G	25 g	$151.00 1/EAAdd To Favorites		Add To Favorites

assay	98%
form	solid
functional group	acyl chloride
	nitrile
InChI	1S/C8H4ClNO/c9-8(11)7-3-1-6(5-10)2-4-7/h1-4H
InChI key	USEDMAWWQDFMFY-UHFFFAOYSA-N
mp	68-70 °C (lit.)
Quality Level	100
SMILES string	ClC(=O)c1ccc(cc1)C#N

Application:	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.
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.
Packaging:	1, 5, 25 g in glass bottle

Symbol	GHS05
Signal word	Danger
Hazard statements	H314
Precautionary statements	P280 - P305 + P351 + P338 - P310
Hazard Codes	C
Risk Statements	34
Safety Statements	26-36/37/39-45
RIDADR	UN 3261 8 / PGII
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable