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Boronic Acid

HCID 61668
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
13780-71-7
Standard SMILES
OBO
InChIKey
ZADPBFCGQRWHPN-UHFFFAOYSA-N
Molecular formula
BH3O2
Average molar mass
45.84 g/mol
Monoisotopic mass
46.02260974

Overview

Boronic acid is the simplest boronic acid, consisting of borane with two of the hydrogens substituted by hydroxy groups.

Names & identifiers

Preferred name
Boronic Acid
IUPAC
boronic acid

Names & synonyms

DihydroxyboranehydridodihydroxidoboronBH(OH)2CHEBI:38267RefChem:121044DTXCID80142345313780-71-7Boronic AcidDTXSID6099643574930-82-8

Database identifiers

CAS
13780-71-7、74930-82-8
PubChem CID
61668
DTXSID
DTXSID60996435
ChEBI
CHEBI:38267

Properties

Computed structural propertiesFilling in

Topological polar surface area
40.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
3
Formal charge
0
Complexity
2.8

Related reactions

817 records
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HRID 38116 reaction equation
HRID 38116As reactantuspto-grants-2013_09
HRID 55865 reaction equation
HRID 55865As reactantuspto-grants-2016_09
HRID 70190 reaction equation
HRID 70190As reactantuspto-grants-2014_09
HRID 86391 reaction equation
HRID 86391As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 88318 reaction equation
HRID 88318As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
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Compound notes

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