4-(1,3,4-Oxadiazol-2-ylphenyl)boronic acid

Name: 4-(1,3,4-Oxadiazol-2-ylphenyl)boronic acid
Brand: ChemScene
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CAS No. 276694-22-5
Cat. No. CS-0188866
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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4-(1,3,4-Oxadiazol-2-ylphenyl)boronic acid|CS-0188866

Structure of 276694-22-5

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General Information

CAS No. 276694-22-5
Cat. No. CS-0188866
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇BN₂O₃
Molecular Weight 189.96
Synonym(s) [4-(1,3,4-oxadiazol-2-yl)phenyl]boronic Acid
SMILES OB(O)C=1C=CC(=CC1)C2=NN=CO2

Synthesis

Route1
- 41420-90-0
- 5419-55-6
- ~82%
- 276694-22-5
References
- ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2007/10235 A1, 2007 ; Location in patent: Page/Page column 32 ; WO 2007/010235 A1
Route2
- 41420-90-0
- ~88%
- 276694-22-5
References
- ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2005/80403 A2, 2005 ; Location in patent: Page/Page column 11-12 ; WO 2005/080403 A2

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

TPSA 79.38
LogP -0.5836
H_Acceptors 5
H_Donors 2
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Oxadiazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-(1,3,4-Oxadiazol-2-ylphenyl)boronic acid

CAS No. 276694-22-5

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General Information

Synthesis

References