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465194

Sigma-Aldrich

Methyl 2-chlorobenzoate

≥98%

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About This Item

Fórmula lineal:
ClC6H4CO2CH3
Número de CAS:
610-96-8
Peso molecular:
170.59
EC Number:
210-242-0
MDL number:
MFCD00016337
UNSPSC Code:
12352100
PubChem Substance ID:
24870253
NACRES:
NA.22
form:
liquid
assay:
≥98%

assay

≥98%

form

liquid

refractive index

n20/D 1.536 (lit.)

bp

86-88 °C/2.5 mmHg (lit.)

density

1.191 g/mL at 25 °C (lit.)

SMILES string

COC(=O)c1ccccc1Cl

InChI

1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3

InChI key

JAVRNIFMYIJXIE-UHFFFAOYSA-N

General description

Methyl 2-chlorobenzoate, a methyl 2-halobenzoate,[1] is an ester. It can be synthesized from 2-chlorobenzoyl chloride.[2] Its reduction with NaBH4 in diglyme at 162°C affords 2-chlorobenzyl alcohol.[2]

Application

Methyl 2-chlorobenzoate may be used in the synthesis of various quinazolinone derivatives.[1] It was used as starting reagent in the synthesis of 2-chlorobenzohydrazide.[3]

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

228.2 °F - closed cup

flash_point_c

109.00 °C - closed cup

ppe

Eyeshields, Gloves

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Certificados de análisis (COA)

Lot/Batch Number
MKCB0596V
MKBL5946V
MKBL5466V
00997KJV
00997KJ

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Navin B Patel et al.
Scientia pharmaceutica, 78(2), 171-193 (2010-12-24)
In attempt to find new pharmacologically active molecules, we report here the synthesis and in vitro antimicrobial activity of various 3-(1,3,4-oxadiazol-2-yl)-quinazolin-4(3H)-ones. The antimicrobial activity of title compounds were examined against two gram positive bacteria (S. aureus, S. pyogenes), two gram
Reductions of Carboxylic Acids and Esters with NaBH4 in Diglyme at 162?C.
Zhu H-J and Pittman Jr CU.
Synthetic Communications, 33(10), 1733-1750 (2003)
Nicholas R Larson et al.
Journal of medical entomology, 57(1), 187-191 (2019-09-10)
Common bed bug Cimex lectularius (L.) (Hemiptera: Cimicidae) infestations are on the rise and due to the development of pesticide resistance they are becoming more difficult to control, affordably. We evaluated a naturally occurring compound methyl benzoate (MB) and related
Cheng Huang et al.
Chemical communications (Cambridge, England), (47)(47), 6333-6335 (2008-12-03)
We have developed a general and highly efficient copper-catalyzed method for synthesis of quinazoline and quinazolinone derivatives, the target products were obtained in good to excellent yields via cascade reactions of amidine hydrochlorides with substituted 2-halobenzaldehydes, 2-halophenylketones, or methyl 2-halobenzoates
Yan Feng et al.
Scientific reports, 8(1), 7902-7902 (2018-05-23)
Benzyl methyl ester, also known as methyl benzoate (MB), is a volatile organic compound that exists naturally as a floral fragrance in many plants. Our behavioral bioassays show that MB and some of its naturally occurring and synthetic analogs kill

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