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Compound
4-Chlorophenyl borate
HCID
86756166
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Basic information
Names & identifiers
Properties
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Basic information
Standard SMILES
[O-]B([O-])Oc1ccc(Cl)cc1
InChIKey
ZOGXJKWVNCKQSG-UHFFFAOYSA-N
Molecular formula
C6H4BClO3-2
Average molar mass
170.36 g/mol
Monoisotopic mass
169.9942018
Names & identifiers
Preferred name
4-Chlorophenyl borate
IUPAC
(4-chlorophenoxy)-dioxidoborane
Names & synonyms
4-chlorophenyl borate
4-chloro-phenyl borate
ZOGXJKWVNCKQSG-UHFFFAOYSA-N
Database identifiers
PubChem CID
86756166
Properties
Computed structural properties
Topological polar surface area
55.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Formal charge
-2
Complexity
114
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Related reactions
7 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
566005
As reactant
uspto-grants-2001_01
HRID
1127718
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID
1207398
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID
1277180
As reactant
uspto-grants-2000_12
HRID
1387934
As reactant
uspto-grants-2001_07
HRID
1978572
As reactant
uspto-grants-2001_05
HRID
2228195
As reactant
uspto-grants-2002_07
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