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Merck
CN

320544

Thionyl chloride

ReagentPlus®, ≥99%

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About This Item

Linear Formula:
SOCl2
CAS Number:
7719-09-7
Molecular Weight:
118.97
EC Number:
231-748-8
UNSPSC Code:
12352300
PubChem Substance ID:
24859270
Beilstein/REAXYS Number:
1209273
MDL number:
MFCD00011449

Key Documents

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InChI key

FYSNRJHAOHDILO-UHFFFAOYSA-N

InChI

1S/Cl2OS/c1-4(2)3

SMILES string

ClS(Cl)=O

vapor pressure

97 mmHg ( 20 °C)

product line

ReagentPlus®

assay

≥99%

form

liquid

refractive index

n20/D 1.518 (lit.)

bp

79 °C (lit.)

mp

−105 °C (lit.)

density

1.631 g/mL at 25 °C (lit.)

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Legal Information

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

signalword

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Skin Corr. 1A - STOT SE 3

target_organs

Respiratory system

supp_hazards

EUH014,EUH029

Storage Class

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

wgk

WGK 1

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
SHBC6888V
SHBC1071V
SHBB3375V
SHBB0665V
BCBF1978V

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Eagleson M.
Concise Encyclopedia Chemistry, 1056-1056 (1994)
High-resolution synchrotron far infrared spectroscopy of thionyl chloride: Analysis of the ?3 and ?6 fundamental bands.
Martin-Drumel MA, et al.
Journal of Molecular Spectroscopy (2015)
Eagleson M.
Concise Encyclopedia Chemistry, 118-118 (1994)
Hend N Hafez et al.
Bioorganic & medicinal chemistry letters, 19(15), 4143-4147 (2009-06-23)
Chlorosulfonation of 3-methyl[1,2,4]triazolo[4,3-a]pyrimidine with chlorosulfonic acid in the presence of thionyl chloride was studied. When triazolo[4,3-a]pyrimidines are used as substrates, the substitution occurs at C-6. Also the reactivity of the hydrazides (7) towards aldehydes, thioglycolic acid and amines were studies.
Meng Zhou et al.
Molecules (Basel, Switzerland), 20(6), 10122-10130 (2015-06-04)
Pincer (Phebox)Ir(mesityl)(OAc) (2) (Phebox = 3,5-dimethylphenyl-2,6-bis(oxazolinyl)) complex, formed by benzylic C-H activation of mesitylene (1,3,5-trimethylbenzene) using (Phebox)Ir(OAc)2OH2 (1), was treated with thionyl chloride to rapidly form 1-(chloromethyl)-3,5-dimethylbenzene in 50% yield at 23 °C. A green species was obtained at the
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