Basic information
- Standard SMILES
OB(O)c1cccc2c1oc1c(-c3ccccc3)cccc12- InChIKey
UYZXLKMREZFZPU-UHFFFAOYSA-N- Molecular formula
- C18H13BO3
- Average molar mass
- 288.1 g/mol
- Monoisotopic mass
- 288.09577468
Names & identifiers
- Preferred name
- (6-Phenyldibenzo[b,d]furan-4-yl)boronic acid
- IUPAC
- (6-phenyldibenzofuran-4-yl)boronic acid
- English name
- Boronic acid, B-(6-phenyl-4-dibenzofuranyl)-
- Molecular formula
- C18H13BO3
- Molecular weight
- 288.11
Names & synonyms
1010068-85-5(6-Phenyldibenzo[b,d]furan-4-yl)boronic acid(6-phenyldibenzofuran-4-yl)boronic acidBoronic acid, B-(6-phenyl-4-dibenzofuranyl)-6-Phenyldibenzofuran-4-boronic AcidMFCD29077673B-(6-phenyl-4-dibenzofuranyl)-Boronic acidAS-55775{10-phenyl-8-oxatricyclo[7.4.0.0(2),?]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl}boronic acid{10-phenyl-8-oxatricyclo[7.4.0.0?,?]trideca-1(9),2(7),3,5,10,12-hexaen-6-yl}boronic acidBoronic acid,B-(6-phenyl-4-dibenzofuranyl)-SCHEMBL14935848
Show more names
BDPFR-B(6-phenyl-4a,9b-dihydrodibenzo[b,d]furan-4-yl)boronic acid(6-Phenyldibenzo[b,d]furan-4-yl)boronic acid(Contains varying amounts of anhydride)
SCHEMBL30886452UYZXLKMREZFZPU-UHFFFAOYSA-NDTXSID001269396CS-B1242AKOS027430370SY273337B-(6-Phenyl-4-dibenzofuranyl)-boronicacidB-(6-Phenyl-4-dibenzofuranyl)boronic acid
Database identifiers
- CAS
1010068-85-5- PubChem CID
- 89556926
- DTXSID
DTXSID001269396
Properties
Computed structural properties
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 383
Physicochemical properties
- Boiling point
- 543.1 · 543.1±42.0 °C(Predicted)
- Density
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 8 · 8.00±0.30(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C18H13BO3/c20-19(21)16-11-5-10-15-14-9-4-8-13(17(14)22-18(15)16)12-6-2-1-3-7-12/h1-11,20-21H
- InChIKey
- UYZXLKMREZFZPU-UHFFFAOYSA-N
- SMILES
- B(C1=C2C(=CC=C1)C1=CC=CC(C3=CC=CC=C3)=C1O2)(O)O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesB-(6-phenyl-4-dibenzofuranyl)-Boronic acid is used as an organic reagent in organic synthesis and experimental research.
Upstream & downstream products
Upstream raw materials
Suppliers50 total
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