B(C1=C(C=C(C=C1)Cl)Cl)(O)O
CAS: 68716-47-2
Name: (2,4-dichlorophenyl)boronic acid
SMILES: B(C1=C(C=C(C=C1)Cl)Cl)(O)O

Molecular Processing

Molecular formula
C6H5BCl2O2
Molecular weight
190.82
Exact mass
189.976
XLogP
0.67
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
46.29

Supplementary Information

InChIKey: QNEGDGPAXKYZHZ-UHFFFAOYSA-N
Synonyme
(2,4-dichlorophenyl)boronic acidRefChem:394576674-975-12,4-Dichlorophenylboronic acid68716-47-22,4-Dichlorobenzeneboronic acidMFCD000139302,4-Dichlorophenyl boronic acidCHEMBL20726Boronic acid, B-(2,4-dichlorophenyl)-2,4-Dichlorophenylboronicacid2,4-dichlorophenylbornic acid(2,4-Dichlorophenyl)BoranediolBoronic acid, (2,4-dichlorophenyl)-SCHEMBL419902,4-dichlorphenylboronic acid2 4-dichlorophenylboronic acid2,4-Dichlorobenzenboronic acid2,4-dichlorobezeneboronic acidorb29400452,4-dichloro benzeneboronicacid2,4-dichlorbenzene boronic acid2,4-dichloro-phenylboronic acid2,4-dichlorophenyl-boronic acidSCHEMBL29375771(2,4-dichlorphenyl)boronic acid2,4-dichloro-benzeneboronic acidDTXSID703704292,4-dichloro phenyl boronic acid2,4-Dichloro-phenyl boronic acid
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