4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol

C11H24O2Si — CID 71340946

IUPAC4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
SMILESCC(=CCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7,12H,8-9H2,1-6H3
InChIKeyDAEPLOLXVLUEEE-UHFFFAOYSA-N
MW216.40 g/mol
LogP2.95
Rot. Bonds4

About 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol

4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol (PubChem CID 71340946) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
PubChem CID71340946
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
SMILESCC(=CCO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7,12H,8-9H2,1-6H3
InChIKeyDAEPLOLXVLUEEE-UHFFFAOYSA-N
XLogP2.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

acetic acid;4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
CID 71342470
tert-butyl-dimethyl-[(Z)-2-methylhex-2-enoxy]silane
CID 89381539
(E)-6-[tert-butyl(dimethyl)silyl]oxy-5-methylhex-4-enal
CID 10466927
tert-butyl-[(2E,6E)-8-chloro-2,6-dimethylocta-2,6-dienoxy]-dimethylsilane
CID 10979583
(E)-4-[tert-butyl(diphenyl)silyl]oxy-3-methylbut-2-en-1-ol
CID 46192380
tert-butyl-[(2E)-2,6-dimethyl-9-phenylnona-2,6-dienoxy]-dimethylsilane
CID 59479992
2-acetyl-10-[tert-butyl(dimethyl)silyl]oxy-5,9-dimethyldeca-4,8-dienoic acid
CID 88524635
7-[tert-butyl(dimethyl)silyl]oxy-2-methylhept-2-en-1-ol
CID 74029317
tert-butyl-dimethyl-(2-methylidenebut-3-enoxy)silane
CID 10058581
tert-butyl-dimethyl-[(Z)-2-methyl-3-[(R)-(4-methylphenyl)sulfinyl]prop-2-enoxy]silane
CID 24881766
[2-[3-[tert-butyl(dimethyl)silyl]oxy-2-methylprop-1-enyl]-4-pyridinyl]methanol
CID 57368643
methyl (6E,10E)-12-[tert-butyl(dimethyl)silyl]oxy-3-hydroxy-7,11-dimethyldodeca-6,10-dienoate
CID 14805432

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol (CID 71340946) is 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol is CC(=CCO)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol?
The InChIKey is DAEPLOLXVLUEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2Si/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7,12H,8-9H2,1-6H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol?
4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol has a molecular weight of 216.40 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol is sourced from PubChem (CID 71340946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).