CAS: 109299-78-7
名称: pyrimidin-5-ylboronic acid
SMILES:
B(C1=CN=CN=C1)(O)OMolecular Processing
Molecular formula
C4H5BN2O2
Molecular weight
123.91
Exact mass
124.0444
XLogP
-1.84
TPSA
66.24
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
9
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
Molar refractivity
31.86
Supplementary Information
InChIKey: HZFPPBMKGYINDF-UHFFFAOYSA-N
同義語
(pyrimidin-5-yl)boronic acidRefChem:406921673-929-8109299-78-75-Pyrimidinylboronic acidPyrimidine-5-boronic acidpyrimidin-5-ylboronic acid5-pyrimidineboronic acid5-Pyrimidylboronic AcidMFCD030023665-pyrimidine boronic acid5-Pyrimidinylboronic acid;Pyrimidine-5-boronic acidpyrimidin-5-boronic acidBORONIC ACID, 5-PYRIMIDINYL-pyrimidin-5-yl boronic acidpyrimidin-5-yl-5-boronic acid5-pyrimidyl-boronic acidpyrimid-5-ylboronic acidpyrimidin-5-ylboronicacidpyrimidine 5-boronic acid5-pyrimidinyl boronic acid5-pyrimidinyl-boronic acidpyrimidinyl-5-boronic acidpyrimidine-5-ylboronic acidSCHEMBL9139pyrimidin-5-yl-boronic acidpyrimidine-5-yl boronic acidpyrimidine-5-yl-boronic aciddihydroxy(5-pyrimidinyl)borane(pyrimidin-5-yl) boronic acid
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