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Merck
CN

V800077

Benzoyl chloride

AR, ≥99%

Synonym(s):

Benzoic acid chloride, alpha-chlorobenzaldehyde

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About This Item

Linear Formula:
C6H5COCl
CAS Number:
98-88-4
Molecular Weight:
140.57
EC Number:
202-710-8
UNSPSC Code:
12352300
PubChem Substance ID:
329829137
Beilstein/REAXYS Number:
471389
MDL number:
MFCD00000653

Key Documents

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InChI key

PASDCCFISLVPSO-UHFFFAOYSA-N

InChI

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

SMILES string

ClC(=O)c1ccccc1

grade

AR

vapor density

4.88 (vs air)

vapor pressure

1 mmHg ( 32 °C)

product line

Vetec™

assay

≥99%

autoignition temp.

1056 °F

expl. lim.

4.9 %

Quality Level

100

bp

198 °C (lit.)

mp

−1 °C (lit.)

density

1.211 g/mL at 25 °C (lit.)

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Legal Information

Vetec is a trademark of Merck KGaA, Darmstadt, Germany

pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

signalword

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Dermal - Acute Tox. 4 Oral - Eye Dam. 1 - Skin Corr. 1B - Skin Sens. 1

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 1

flash_point_f

161.6 °F - closed cup

flash_point_c

72 °C - closed cup

Regulatory Information

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T William Bentley et al.
The Journal of organic chemistry, 70(5), 1647-1653 (2005-02-26)
Product selectivities [S = ([ester product]/[acid product]) x ([water]/[alcohol solvent])] are reported for solvolyses of p-methoxybenzoyl chloride (2) in aqueous methanol, ethanol, 2,2,2-trifluoroethanol, n-propyl alcohol, isopropyl alcohol, and tert-butyl alcohol at 25, 35, and 45 degrees C. S values are
Luca Zoia et al.
Journal of agricultural and food chemistry, 59(3), 829-838 (2011-01-18)
A novel and reproducible method is described for accurately determining the molecular weight distribution by size exclusion chromatography (SEC) of whole lignocellulosic materials. This approach offers the opportunity to compare the molecular weight distributions of intact milled woods and its
Iterative dianion relay along the ring: formation of gem-bis(trimethylsilyl) cyclopentenones from 2,5-bis(trimethylsilyl) oxy-cyclopentadienyl dianions and acid chlorides.
Heng Li et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 17(27), 7399-7403 (2011-05-28)
P Campos-Rey et al.
The journal of physical chemistry. B, 114(44), 14004-14011 (2010-10-20)
The solvolysis of substituted benzoyl chlorides is sensitive both to substituent electronic effects and to medium effects. The solvolysis reactions of substituted benzoyl chlorides have been analyzed in the presence of nonionic micelles. The reaction is inhibited or catalyzed depending
Peng Song et al.
Analytical chemistry, 84(1), 412-419 (2011-11-29)
In vivo neurochemical monitoring using microdialysis sampling is important in neuroscience because it allows correlation of neurotransmission with behavior, disease state, and drug concentrations in the intact brain. A significant limitation of current practice is that different assays are utilized
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