(tert-butyl-ethyl-methylsilyl)oxyboronic acid

C7H19BO3Si — CID 175184174

IUPAC(tert-butyl-ethyl-methylsilyl)oxyboronic acid
SMILESCC[Si](C)(OB(O)O)C(C)(C)C
InChIInChI=1S/C7H19BO3Si/c1-6-12(5,7(2,3)4)11-8(9)10/h9-10H,6H2,1-5H3
InChIKeyGGKPECIXSLBTAS-UHFFFAOYSA-N
MW190.12 g/mol
LogP1.37
Rot. Bonds3

About (tert-butyl-ethyl-methylsilyl)oxyboronic acid

(tert-butyl-ethyl-methylsilyl)oxyboronic acid (PubChem CID 175184174) has the molecular formula C7H19BO3Si and a molecular weight of 190.12 g/mol. Its IUPAC name is (tert-butyl-ethyl-methylsilyl)oxyboronic acid.

Molecular Properties

Compound Name(tert-butyl-ethyl-methylsilyl)oxyboronic acid
PubChem CID175184174
Molecular FormulaC7H19BO3Si
Molecular Weight190.12 g/mol
Exact Mass190.12
IUPAC Name(tert-butyl-ethyl-methylsilyl)oxyboronic acid
SMILESCC[Si](C)(OB(O)O)C(C)(C)C
InChIInChI=1S/C7H19BO3Si/c1-6-12(5,7(2,3)4)11-8(9)10/h9-10H,6H2,1-5H3
InChIKeyGGKPECIXSLBTAS-UHFFFAOYSA-N
XLogP1.37
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.12
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane
CID 87069102
2-[amino(diethyl)silyl]-2-methylpropane
CID 169160117
tert-butyl-ethyl-dihydroxysilane
CID 87762514
tert-butyl-bis(ethoxymethyl)-methylsilane
CID 166518836
tris[ethyl(dimethyl)silyl] borate
CID 87157045
tert-butyl-methyl-dipropylsilane
CID 141134978
tert-butyl-chloro-dimethylsilane;ethoxyethane
CID 90417785
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
[tert-butyl(dimethyl)silyl] N-[tert-butyl(dimethyl)silyl]propanimidate
CID 529237
2,3-dimethylpentan-2-yloxyboronic acid
CID 54520879
tert-butyl-[tert-butyl-(chloromethyl)-methylsilyl]oxy-dimethylsilane
CID 90417786
(3R)-3-[tert-butyl(dimethyl)silyl]oxypentan-1-ol
CID 10900101

Frequently Asked Questions

What is the IUPAC name of (tert-butyl-ethyl-methylsilyl)oxyboronic acid?
The IUPAC name of (tert-butyl-ethyl-methylsilyl)oxyboronic acid (CID 175184174) is (tert-butyl-ethyl-methylsilyl)oxyboronic acid.
What is the SMILES notation for (tert-butyl-ethyl-methylsilyl)oxyboronic acid?
The canonical SMILES for (tert-butyl-ethyl-methylsilyl)oxyboronic acid is CC[Si](C)(OB(O)O)C(C)(C)C.
What is the InChIKey of (tert-butyl-ethyl-methylsilyl)oxyboronic acid?
The InChIKey is GGKPECIXSLBTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19BO3Si/c1-6-12(5,7(2,3)4)11-8(9)10/h9-10H,6H2,1-5H3.
What are the key properties of (tert-butyl-ethyl-methylsilyl)oxyboronic acid?
(tert-butyl-ethyl-methylsilyl)oxyboronic acid has a molecular weight of 190.12 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (tert-butyl-ethyl-methylsilyl)oxyboronic acid is sourced from PubChem (CID 175184174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).