4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol

C13H30OSi — CID 123364705

IUPAC4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol
SMILESCC(C)(O)CC(C)(C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H30OSi/c1-11(2,3)15(8,9)13(6,7)10-12(4,5)14/h14H,10H2,1-9H3
InChIKeyZXOXRVYFMKEOBY-UHFFFAOYSA-N
MW230.47 g/mol
LogP4.44
Rot. Bonds3

About 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol

4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol (PubChem CID 123364705) has the molecular formula C13H30OSi and a molecular weight of 230.47 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol
PubChem CID123364705
Molecular FormulaC13H30OSi
Molecular Weight230.47 g/mol
Exact Mass230.21
IUPAC Name4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol
SMILESCC(C)(O)CC(C)(C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H30OSi/c1-11(2,3)15(8,9)13(6,7)10-12(4,5)14/h14H,10H2,1-9H3
InChIKeyZXOXRVYFMKEOBY-UHFFFAOYSA-N
XLogP4.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.47
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Methyl-4-trimethylsilyl-2-butanol
CID 12702675
5-Dimethylsilyl-1,1,1-trifluoro-2-methylpentan-2-ol
CID 147548422
2-Methyl-4-trimethylsilylheptan-2-ol
CID 85843087
3-Ethyl-1-trimethylsilylpentan-3-ol
CID 86177948
trans-(1R,2R)-1-propyl-2-trimethylsilylcyclopropan-1-ol
CID 101091246
5-Hydroxy-5,5-dimethylpentyl-trimethylsilane
CID 129828664
3-Methyl-1-trimethylsilylpentan-3-ol
CID 134978613
cis-(1R,2S)-1-propyl-2-trimethylsilylcyclopropan-1-ol
CID 134997612
4-[2-[Fluoro(dimethyl)silyl]ethyl]heptan-4-ol
CID 10727675
2-Methyl-5,5,5-tris(trimethylsilyl)pentan-2-ol
CID 18684361
1-Trimethylsilylmethylcyclopentanol
CID 23496719
1,1-Dimethyl-3-(triethylsilyl)propyl alcohol
CID 53786269

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol (CID 123364705) is 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol is CC(C)(O)CC(C)(C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol?
The InChIKey is ZXOXRVYFMKEOBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30OSi/c1-11(2,3)15(8,9)13(6,7)10-12(4,5)14/h14H,10H2,1-9H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol?
4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol has a molecular weight of 230.47 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]-2,4-dimethylpentan-2-ol is sourced from PubChem (CID 123364705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).