B(C1=CC(=CC(=C1)Cl)Cl)(O)O
CAS: 67492-50-6
名称: (3,5-dichlorophenyl)boronic acid
SMILES: B(C1=CC(=CC(=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: DKYRKAIKWFHQHM-UHFFFAOYSA-N
同義語
3,5-Dichlorophenylboronic acid67492-50-6DTXSID70370222RefChem:271695DTXCID10321258628-675-2(3,5-dichlorophenyl)boronic Acid3,5-Dichlorobenzeneboronic AcidMFCD000519353,5-Dichlorophenyl boronic acid3,5-dichrolo phenyl boronic acid(3,5-dichlorophenyl)boranediol3,5-Dichlorophenylboronicacid3,5-dichloro phenylboronic acid3,5-Dichlorobenylboronic acidSCHEMBL177673orb29400403,5-dichloro-phenylboronic acid3,5-dichlorophenyl-boronic acid3,5-dichloro benzeneboronic acid3,5-dichlorobenzene boronic acid3, 5-dichlorophenyl boronic acid3,5-dichloro phenyl boronic acid3,5-dichlorophenyl-dihydroxyboraneCS-D1010TYD-005393,5-Dichlorophenylboronic acid, 98%AKOS004116174AB02153AC-5382
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