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Compound
5-Bromo-4-methoxythiophene-2-sulfonamide
HCID
22019529
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Properties
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Compound notes
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Basic information
Standard SMILES
COc1cc(S(N)(=O)=O)sc1Br
InChIKey
DEYCZFMJECHOHU-UHFFFAOYSA-N
Molecular formula
C5H6BrNO3S2
Average molar mass
272.1 g/mol
Names & identifiers
Preferred name
5-Bromo-4-methoxythiophene-2-sulfonamide
IUPAC
5-bromo-4-methoxythiophene-2-sulfonamide
Names & synonyms
5-Bromo-4-methoxythiophene-2-sulfonamide
SCHEMBL5509780
DEYCZFMJECHOHU-UHFFFAOYSA-N
Database identifiers
PubChem CID
22019529
Properties
Computed structural properties
XLogP
1.5
Topological polar surface area
106 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
250
Show all 8
Show all 8 / 8
Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
6963
As product
uspto-grants-2006_08
HRID
175289
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
1297168
As product
uspto-grants-2007_07
Compound notes
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