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Trichlorothiophene-3-sulfonyl chloride

HCID 16639974
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=S(=O)(Cl)c1c(Cl)sc(Cl)c1Cl
InChIKey
OKCHKLVHPLRMLP-UHFFFAOYSA-N
Molecular formula
C4Cl4O2S2
Average molar mass
286 g/mol

Names & identifiers

Preferred name
Trichlorothiophene-3-sulfonyl chloride
IUPAC
2,4,5-trichlorothiophene-3-sulfonyl chloride

Names & synonyms

TRICHLOROTHIOPHENE-3-SULFONYL CHLORIDE56946-85-1SCHEMBL3015389OKCHKLVHPLRMLP-UHFFFAOYSA-NAKOS0002820762,4,5-trichlorothien-3-ylsulfonyl chloride2,4,5-trichlorothiophene-3-sulfonyl chloride2,4,5-Trichloro-thiophene-3-sulfonyl Chloride2.4.5-Trichloro-thiophene-3-sulfonyl chlorideEN300-37462510

Database identifiers

PubChem CID
16639974

Properties

Computed structural propertiesFilling in

XLogP
4.2
Topological polar surface area
70.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
261

Related reactions

3 records
New reaction record
HRID 8632 reaction equation
HRID 8632As productuspto-grants-2006_08
HRID 1205118 reaction equation
HRID 1205118As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1973914 reaction equation
HRID 1973914As productuspto-grants-1976_12

Compound notes

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