CAS: 89787-12-2
名称: (2-propan-2-ylphenyl)boronic acid
SMILES:
B(C1=CC=CC=C1C(C)C)(O)OMolecular 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: KTZUVUWIBZMHMC-UHFFFAOYSA-N
同義語
2-Isopropylbenzeneboronic acidRefChem:473921677-271-289787-12-22-Isopropylphenylboronic acid(2-Isopropylphenyl)Boronic acid2-Isopropylphenyboronic acid(2-propan-2-ylphenyl)boronic AcidMFCD03411937[2-(PROPAN-2-YL)PHENYL]BORONIC ACID2-Isopropylphenboronic acidBORONIC ACID, [2-(1-METHYLETHYL)PHENYL]-2-IsopropylphenylboronicAcidSCHEMBL212702-isopropyl phenylboronic acid2-isopropylphenyl boronic acid2-isopropylbenzene boronic acidorb2940010SCHEMBL29430856DTXSID10378484KTZUVUWIBZMHMC-UHFFFAOYSA-NTYD-00569AKOS000285063AB14291CS-W003050GS-6638HY-W003050SY026620DB-010456EN300-107504
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