p-Boronobenzoic acid
Names
[ CAS No. ]:
14047-29-1
[ Name ]:
p-Boronobenzoic acid
[Synonym ]:
4-(Dihydroxyboryl)benzoic acid
Benzoic acid, 4-borono-
4-Carboxybenzeneboronic Acid
4-Boronobenzoic acid
MFCD00151801
4-Carboxyphenylboronic acid
p-Carboxybenzeneboronic acid
p-Boronobenzoic acid
4-(dihydroxyboranyl)benzoic acid
Biological Activity
[Description]:
[Related Catalog]:
Chemical & Physical Properties
[ Density]:
1.4±0.1 g/cm3
[ Boiling Point ]:
406.4±47.0 °C at 760 mmHg
[ Melting Point ]:
220 °C (dec.)(lit.)
[ Molecular Formula ]:
C7H7BO4
[ Molecular Weight ]:
165.94
[ Flash Point ]:
199.6±29.3 °C
[ Exact Mass ]:
166.043747
[ PSA ]:
77.76000
[ LogP ]:
1.27
[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C
[ Index of Refraction ]:
1.585
[ Storage condition ]:
0-6°C
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- CY8925000
- CHEMICAL NAME :
- Benzeneboronic acid, p-carboxy-
- CAS REGISTRY NUMBER :
- 14047-29-1
- BEILSTEIN REFERENCE NO. :
- 3031088
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H7-B-O4
- MOLECULAR WEIGHT :
- 165.95
- WISWESSER LINE NOTATION :
- VHOR DBQQ
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- APYPAY Acta Physiologica Polonica. (Karger-Libri, POB CH-4009, Warszawa, Switzerland) V.1-41, 1950-90. Volume(issue)/page/year: 12,173,1961
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1740 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 14KTAK "Boron, Metallo-Boron Compounds and Boranes," Adams, R.M., ed., New York, John Wiley & Sons, Inc., 1964 Volume(issue)/page/year: -,693,1964
Safety Information
[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
[ Hazard Codes ]:
Xi:Irritant
[ Risk Phrases ]:
R36/37/38
[ Safety Phrases ]:
S37/39-S26
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
2
[ RTECS ]:
CY8925000
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Articles
Angew. Chem. Int. Ed. Engl. 3rd ed., 51 , 784-788, (2012)
A new access to 3-substituted-1(2H)-isoquinolone by tandem palladium-catalyzed intramolecular aminocarbonylation annulation.
Org. Biomol. Chem. 13th ed., 10 , 2683-2691, (2012)
An original tribromide derivative based, palladium-catalyzed synthesis of 3-substituted-1(2H)-isoquinolone is described based on a regioselective Suzuki-Miyaura C-C coupling on o-halo-(2,2-dihalovinyl...
Synthesis of new trisulfonated calix[4]arenes functionalized at the upper rim, and their complexation with the trimethyllysine epigenetic mark.Org. Lett. 6th ed., 14 , 1512-1515, (2012)
A synthetic route to produce a new family of trisulfonated calix[4]arenes bearing a single group, selectively introduced, that lines the binding pocket is reported. Ten examples, including new sulfona...