1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol

C7H18O2Si — CID 173175101

IUPAC1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol
SMILESCCC(C)(O)C[Si](C)(C)O
InChIInChI=1S/C7H18O2Si/c1-5-7(2,8)6-10(3,4)9/h8-9H,5-6H2,1-4H3
InChIKeyJTFROSZHALMJFX-UHFFFAOYSA-N
MW162.31 g/mol
LogP1.34
Rot. Bonds3

About 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol

1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol (PubChem CID 173175101) has the molecular formula C7H18O2Si and a molecular weight of 162.31 g/mol. Its IUPAC name is 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol
PubChem CID173175101
Molecular FormulaC7H18O2Si
Molecular Weight162.31 g/mol
Exact Mass162.11
IUPAC Name1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol
SMILESCCC(C)(O)C[Si](C)(C)O
InChIInChI=1S/C7H18O2Si/c1-5-7(2,8)6-10(3,4)9/h8-9H,5-6H2,1-4H3
InChIKeyJTFROSZHALMJFX-UHFFFAOYSA-N
XLogP1.34
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.31
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol?
The IUPAC name of 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol (CID 173175101) is 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol.
What is the SMILES notation for 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol?
The canonical SMILES for 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol is CCC(C)(O)C[Si](C)(C)O.
What is the InChIKey of 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol?
The InChIKey is JTFROSZHALMJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O2Si/c1-5-7(2,8)6-10(3,4)9/h8-9H,5-6H2,1-4H3.
What are the key properties of 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol?
1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol has a molecular weight of 162.31 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydroxy(dimethyl)silyl]-2-methylbutan-2-ol is sourced from PubChem (CID 173175101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).