B(C1=CC=C(C=C1)C(C)C)(O)O
CAS: 16152-51-5
Nombre: (4-propan-2-ylphenyl)boronic acid
SMILES: B(C1=CC=C(C=C1)C(C)C)(O)O

Molecular Processing

Molecular formula
C9H13BO2
Molecular weight
164.01
Exact mass
164.1009
XLogP
0.49
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.36

Supplementary Information

InChIKey: IAEUFBDMVKQCLU-UHFFFAOYSA-N
Sinónimos
4-Isopropylphenylboronic acid16152-51-5DTXSID70378485RefChem:524346DTXCID10329512678-567-44-Isopropylbenzeneboronic Acid(4-isopropylphenyl)boronic acid(4-propan-2-ylphenyl)boronic acid4-iso-Propylphenylboronic acidMFCD01074614[4-(propan-2-yl)phenyl]boronic acidBoronic acid, B-[4-(1-methylethyl)phenyl]-4-isopropylphenyl boronic acid4-cumylboronic acid4-Isoprophenylboronic acid4-isopropylphenylboronicacidp-isopropylphenylboronic acidBoronic acid, [4-(1-methylethyl)phenyl]-[4-(propan-2-yl)phenyl]boranediolp-isopropylbenzeneboronic acidSCHEMBL1285754-isopropyl-phenylboronic acidp-isopropyl-phenyl boronic acid4-isopropyl phenyl boronic acid4-isopropyl-phenyl boronic acidIAEUFBDMVKQCLU-UHFFFAOYSA-ALBB-005496CS-D1038SBB047821
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