Basic information
- Standard SMILES
[B]1Oc2ccccc2O1- InChIKey
ZDQWVKDDJDIVAL-UHFFFAOYSA-N- Molecular formula
- C6H4BO2
- Average molar mass
- 118.91 g/mol
Names & identifiers
- Preferred name
- Benzcatechinborane
Names & synonyms
BenzcatechinboraneBenzo[d][1,3,2]dioxaborole2H-1,3,2-benzodioxaboroleCatecholatoboranePyrocatecholboraneMFCD00005846CB; CatecholatoboraneCatecholborane (Technical Grade)1,3,2-benzodioxaborolaneBenzo[1,3,2]dioxaborolecatechol borane1,3,2-Benzodioxaborole; Benzcatechinborane; CB; Catecholatoborane; Pyrocatecholborane;
Show more names
CID 67506Catecholborane, 98%CATECHOLBORANE [MI]SCHEMBL7747SCHEMBL7748C6H4BO21,3,2lambda2-benzodioxaboroleSCHEMBL23273805
Database identifiers
- CAS
274-07-7- PubChem CID
- 6327445
- UNII
- UB69382H5J
- Nikkaji
- J193.697B、J2.186.662H
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 95.2
Related reactions
62 records
Linked notes
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