Molecular properties
- Formula
- C6H5BO2
- Molar mass
- 119.92 g·mol−1
- Exact mass
- 120.0383 Da
- 4.5
- PubChem CID
- 67506
Molecule record
1,3,2-benzodioxaborole
C6H5BO2
119.92 g/mol
Loading structure
Functional groups
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 205-991-5
- 274-07-7
- Catecholborane
- DTXCID3037670
- DTXSID3059769
- EINECS 205-991-5
- F044757
- RefChem:574899
Show all 10 synonyms
- UB69382H5J
- c6h5bo2
Structure identifiers
- Canonical SMILES
- B1Oc2ccccc2O1
- Isomeric SMILES
- B1OC2=CC=CC=C2O1
- InChI
- InChI=1S/C6H5BO2/c1-2-4-6-5(3-1)8-7-9-6/h1-4,7H
- InChIKey
- CENMEJUYOOMFFZ-UHFFFAOYSA-N
- PubChem CID
- 67506
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1,3,2-benzodioxaborole; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1,3,2-benzodioxaborole; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.