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351422-73-6

351422-73-6 Structure

351422-73-6 Structure
IdentificationMore
[Name]

3-Aminocarbonylphenylboronic acid
[CAS]

351422-73-6
[Synonyms]

3-(AMINOCARBONYL)BENZENEBORONIC ACID
3-AMINOCARBONYLPHENYLBORONIC ACID
3-CARBAMOYLPHENYLBORONIC ACID
3-CARBAMOYLPHENYLBORONIC ACID, 3-BORONOBENZAMIDE
3-CARBOXAMIDEPHENYLBORONIC ACID
BENZAMIDE-3-BORONIC ACID
3-AMINOCARBONYLPENYLBORONIC ACID
3-Aminocarbonyiphenylboronic acid
3-AMINOCARBONYPHENYLBORONIC ACID
3-(Aminocarbonyl)Phenylboronic
3-(Aminocarbonyl)benzeneboronic acid 98%
3-Carbamoylbenzeneboronic acid
3-Aminocarbonylphenylboronic acid ,98%
[Molecular Formula]

C7H8BNO3
[MDL Number]

MFCD03411948
[Molecular Weight]

164.95
[MOL File]

351422-73-6.mol
Chemical PropertiesBack Directory
[Melting point ]

221-226 °C
[Boiling point ]

408.1±47.0 °C(Predicted)
[density ]

1.32±0.1 g/cm3(Predicted)
[storage temp. ]

Keep Cold
[solubility ]

soluble in Methanol
[form ]

Solid
[pka]

7.84±0.10(Predicted)
[color ]

White to off-white
[Detection Methods]

HPLC,NMR
[InChI]

1S/C7H8BNO3/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4,11-12H,(H2,9,10)
[InChIKey]

WDGWHKRJEBENCE-UHFFFAOYSA-N
[SMILES]

NC(=O)c1cccc(c1)B(O)O
[CAS DataBase Reference]

351422-73-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Corrosive
[HazardClass ]

IRRITANT
[HS Code ]

29163990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

White to brown solid
[Uses]

Reactant involved in the synthesis of a variety of inhibitors including:
  • Orally active phosphodiesterase 10A inhibitors
  • Pyrimidine derivatives as TpI2 kinase inhibitors
  • Peptidomimetic inhibitors of STAT3 protein

Reactant involved in:
  • Oxidative cross-coupling with mercaptoacetylenes
  • Trifluoromethylation via a Collidine trifluoromethylating agent
  • Suzuki cross-coupling reactions
[Uses]

Reactant involved in the synthesis of a variety of inhibitors including:• ;Orally active phosphodiesterase 10A inhibitors1• ;Pyrimidine derivatives as TpI2 kinase inhibitors2• ;Peptidomimetic inhibitors of STAT3 protein3Reactant involved in:• ;Oxidative cross-coupling with mercaptoacetylenes4• ;Trifluoromethylation via a Collidine trifluoromethylating agent5• ;Suzuki cross-coupling reactions6
[Uses]

suzuki reaction
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

351422-73-6(sigmaaldrich)
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