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(E)-4-(methylsulfonamido) styrylboronic acid

HCID 57775250
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Basic information

Standard SMILES
CS(=O)(=O)Nc1ccc(/C=C/B(O)O)cc1
InChIKey
GFTRCGJGXYGIEJ-VOTSOKGWSA-N
Molecular formula
C9H12BNO4S
Average molar mass
241.08 g/mol

Names & identifiers

Preferred name
(E)-4-(methylsulfonamido) styrylboronic acid
IUPAC
[(E)-2-[4-(methanesulfonamido)phenyl]ethenyl]boronic acid

Names & synonyms

SCHEMBL482620GFTRCGJGXYGIEJ-VOTSOKGWSA-NDB-186768(E)-4-(methylsulfonamido) styrylboronic acidb-[(1e)-2-[4-[(methylsulfonyl)amino]phenyl]ethenyl]boronic acid1132942-08-5

Database identifiers

PubChem CID
57775250

Properties

Computed structural propertiesFilling in

Topological polar surface area
95 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
328

Related reactions

2 records
New reaction record
HRID 403668 reaction equation
HRID 403668As reactantuspto-grants-2014_06
HRID 530652 reaction equation
HRID 530652As reactantuspto-grants-2016_05

Compound notes

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