B(C1=C(ON=C1C)C)(O)O
CAS: 16114-47-9
Name: (3,5-dimethyl-1,2-oxazol-4-yl)boronic acid
SMILES: B(C1=C(ON=C1C)C)(O)O

Molecular Processing

Molecular formula
C5H8BNO3
Molecular weight
140.94
Exact mass
141.0597
XLogP
-1.03
TPSA
66.49
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
35.8

Supplementary Information

InChIKey: DIIFZCPZIRQDIJ-UHFFFAOYSA-N
Synonyme
3,5-Dimethylisoxazole-4-boronic acid16114-47-9DTXSID20370237RefChem:271963DTXCID10321273672-304-7(3,5-dimethylisoxazol-4-yl)boronic acid(3,5-dimethyl-1,2-oxazol-4-yl)boronic Acid(dimethyl-1,2-oxazol-4-yl)boronic acidMFCD02677945Boronic acid, B-(3,5-dimethyl-4-isoxazolyl)-3,5-dimethyl-4-isoxazolylboronic acidC5H8BNO33,5-DIMETHYLISOXAZOL-4-YL-4-BORONIC ACID3,5-Dimethylisoxazole-4-boronicacid3,5-dimethyl-4-isoxazoleboronic acid(3,5-Dimethyl-4-isoxazolyl)-boronic acidBoronic acid, (3,5-dimethyl-4-isoxazolyl)-3,5-dimethylisoxazol-4-ylboronic acid3,5-dimethyl-4-isoxazole boronic acid3,5-Dimethyl-isoxazole-4-boronic acid(3,5-dimethyl-4-isoxazolyl)boronic acid(3,5-Dimethyl-1,2-Oxazol-4-Yl)BoranediolSCHEMBL68794DIIFZCPZIRQDIJ-UHFFFAOYSA-N3,5-Dimethyisoxazole-4-boronic acid3,5-dimethylisoxazol-4-boronic acidSBB0041603,5-dimethylisoxazole-4 boronic acid3,5-dimethyl-isoxazol-4-boronic acid
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