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

C11H22O2Si — CID 11095976

IUPAC1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol
SMILESC#CC(C)(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8-11(5,12)9-13-14(6,7)10(2,3)4/h1,12H,9H2,2-7H3
InChIKeyKQFZFWLFMSFRMY-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.39
Rot. Bonds3

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

1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol (PubChem CID 11095976) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol
PubChem CID11095976
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol
SMILESC#CC(C)(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8-11(5,12)9-13-14(6,7)10(2,3)4/h1,12H,9H2,2-7H3
InChIKeyKQFZFWLFMSFRMY-UHFFFAOYSA-N
XLogP2.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-ynyl)amino]-2-[[methyl(prop-2-ynyl)amino]methyl]propan-2-ol
CID 135019809
tert-butyl-(2,2-difluoropropoxy)-dimethylsilane
CID 123170783
(2S)-1-[tert-butyl(dimethyl)silyl]oxybut-3-yn-2-ol
CID 20848710
3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropane-1,1-diol
CID 123722416
5-[ethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol
CID 162424550
(NE)-N-[3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropylidene]hydroxylamine
CID 121006548
tert-butyl-dimethyl-(2-methylbut-3-ynoxy)silane
CID 10584128
tert-butyl-(3-ethynoxypropoxy)-dimethylsilane
CID 176737355
tert-butyl-dimethyl-[(Z)-pent-2-en-4-ynoxy]silane
CID 135083715
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
tert-butyl-hexadec-15-ynoxy-dimethylsilane
CID 23073442
N-[1,3-bis[[tert-butyl(dimethyl)silyl]oxy]-2-[[tert-butyl(dimethyl)silyl]oxymethyl]propan-2-yl]acetamide
CID 91697077

Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol (CID 11095976) is 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol is C#CC(C)(O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol?
The InChIKey is KQFZFWLFMSFRMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-8-11(5,12)9-13-14(6,7)10(2,3)4/h1,12H,9H2,2-7H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol?
1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol has a molecular weight of 214.38 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol is sourced from PubChem (CID 11095976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).