Benzeneboronic acid, 1,2-(4,5-dichlorophenylene) ester
Basic information
- CAS
73688-88-7- Standard SMILES
Clc1cc2c(cc1Cl)OB(c1ccccc1)O2- InChIKey
BQVWFNYJTACZFE-UHFFFAOYSA-N- Molecular formula
- C12H7BCl2O2
- Average molar mass
- 264.9 g/mol
- Monoisotopic mass
- 263.991615
Names & identifiers
- Preferred name
- Benzeneboronic acid, 1,2-(4,5-dichlorophenylene) ester
- IUPAC
- 5,6-dichloro-2-phenyl-1,3,2-benzodioxaborole
- English name
- 5,6-Dichloro-2-phenyl-1,3,2-benzodioxaborole
- Molecular formula
- C12H7BCl2O2
- Molecular weight
- 264.9
Names & synonyms
5,6-dichloro-2-phenyl-1,3,2-benzodioxaborole73688-88-7Benzeneboronic acid, 1,2-(4,5-dichlorophenylene) esterQQH2EP7NLHNSC 221138NSC-221138DTXSID80223972RefChem:199744DTXCID101464631,2-(4,5-Dichlorophenylene) benzeneboronate1,3,2-Benzodioxaborole, 5,6-dichloro-2-phenyl-NSC221138
Show more names
UNII-QQH2EP7NLH5,6-dichloro-2-phenyl-2H-1,3,2-benzodioxaborole5,6-Dichloro-2-phenylbenzo[d][1,3,2]dioxaborole1,5-Dichlorophenylene) benzeneboronate1,2-Benzodioxaborole, 5,6-dichloro-2-phenyl-Benzeneboronic acid,2-(4,5-dichlorophenylene) ester
Database identifiers
- CAS
73688-88-7- PubChem CID
- 99362
- DTXSID
DTXSID80223972- UNII
- QQH2EP7NLH
- Nikkaji
- J149.263B
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- FDA UNII
- 2 EP7NLH · QQH2EP7NLH
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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