(4-trimethylsilylphenyl)boronic acid

C9H15BO2Si — CID 1710

IUPAC(4-trimethylsilylphenyl)boronic acid
SMILESC[Si](C)(C)c1ccc(B(O)O)cc1
InChIInChI=1S/C9H15BO2Si/c1-13(2,3)9-6-4-8(5-7-9)10(11)12/h4-7,11-12H,1-3H3
InChIKeyNRPZMSUGPMYBCQ-UHFFFAOYSA-N
MW194.12 g/mol
LogP-0.09
Rot. Bonds2

About (4-trimethylsilylphenyl)boronic acid

(4-trimethylsilylphenyl)boronic acid (PubChem CID 1710) has the molecular formula C9H15BO2Si and a molecular weight of 194.12 g/mol. Its IUPAC name is (4-trimethylsilylphenyl)boronic acid.

Molecular Properties

Compound Name(4-trimethylsilylphenyl)boronic acid
PubChem CID1710
Molecular FormulaC9H15BO2Si
Molecular Weight194.12 g/mol
Exact Mass194.09
IUPAC Name(4-trimethylsilylphenyl)boronic acid
SMILESC[Si](C)(C)c1ccc(B(O)O)cc1
InChIInChI=1S/C9H15BO2Si/c1-13(2,3)9-6-4-8(5-7-9)10(11)12/h4-7,11-12H,1-3H3
InChIKeyNRPZMSUGPMYBCQ-UHFFFAOYSA-N
XLogP-0.09
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.12
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Phenylboronic Acid
CID 66827
Ethylphenyldichlorosilane
CID 14304
Trimethoxyphenylsilane
CID 18137
Diphenylsilanediol
CID 13693
(Dimethoxymethylsilyl)benzene
CID 18193
Phenyl Dimethicone
CID 3032548
Chlorodimethylphenylsilane
CID 13029
(Chloromethyl)dimethylphenylsilane
CID 74598
Silanol, 1,1-dimethyl-1-phenyl-
CID 78929
1,4-Bis(trimethylsilyl)benzene
CID 25771
1,4-Phenylenebis(dimethylsilane)
CID 6328729
Dimethylphenylsilane
CID 13014

Frequently Asked Questions

What is the IUPAC name of (4-trimethylsilylphenyl)boronic acid?
The IUPAC name of (4-trimethylsilylphenyl)boronic acid (CID 1710) is (4-trimethylsilylphenyl)boronic acid.
What is the SMILES notation for (4-trimethylsilylphenyl)boronic acid?
The canonical SMILES for (4-trimethylsilylphenyl)boronic acid is C[Si](C)(C)c1ccc(B(O)O)cc1.
What is the InChIKey of (4-trimethylsilylphenyl)boronic acid?
The InChIKey is NRPZMSUGPMYBCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15BO2Si/c1-13(2,3)9-6-4-8(5-7-9)10(11)12/h4-7,11-12H,1-3H3.
What are the key properties of (4-trimethylsilylphenyl)boronic acid?
(4-trimethylsilylphenyl)boronic acid has a molecular weight of 194.12 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-trimethylsilylphenyl)boronic acid is sourced from PubChem (CID 1710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).