[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol

C13H26O2Si — CID 11118241

IUPAC[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
SMILESCC1=C(CO)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-10-7-8-12(11(10)9-14)15-16(5,6)13(2,3)4/h12,14H,7-9H2,1-6H3
InChIKeyBHNQDFGHYBXGLL-UHFFFAOYSA-N
MW242.43 g/mol
LogP3.48
Rot. Bonds3

About [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol

[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol (PubChem CID 11118241) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol.

Molecular Properties

Compound Name[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
PubChem CID11118241
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
SMILESCC1=C(CO)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-10-7-8-12(11(10)9-14)15-16(5,6)13(2,3)4/h12,14H,7-9H2,1-6H3
InChIKeyBHNQDFGHYBXGLL-UHFFFAOYSA-N
XLogP3.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 53.48
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

2-{[(Tert-butyldimethylsilyl)oxy]methyl}cyclohex-2-en-1-ol
CID 85788879
(1R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-iodo-3-methylcyclopent-2-en-1-ol
CID 16071335
[4-[Tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
CID 16115547
(1R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-2-en-1-ol
CID 101808796
2-[Tert-butyl(dimethyl)silyl]oxy-3-methylcyclopent-2-en-1-ol
CID 132564841
1-(2-Ethynylcyclopenten-1-yl)-4-trimethylsilylbut-2-yn-1-ol
CID 134884576
4-Methyl-1-(2-prop-1-ynylcyclopenten-1-yl)-4-trimethylsilylpent-2-yn-1-ol
CID 134897048
[6-[Tert-butyl(dimethyl)silyl]oxycyclohexen-1-yl]methanol
CID 134965784
(E)-7-[tert-butyl(dimethyl)silyl]oxy-3-methylhept-2-en-4-ol
CID 135037292
(1R,5R)-5-[tert-butyl(dimethyl)silyl]oxy-3-(hydroxymethyl)-2-methylcyclopent-2-en-1-ol
CID 135040437
[(3R,5S)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-(hydroxymethyl)cyclopenten-1-yl]methanol
CID 154707119
(1S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-2-en-1-ol
CID 164668674

Frequently Asked Questions

What is the IUPAC name of [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol?
The IUPAC name of [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol (CID 11118241) is [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol.
What is the SMILES notation for [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol?
The canonical SMILES for [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol is CC1=C(CO)C(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol?
The InChIKey is BHNQDFGHYBXGLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-10-7-8-12(11(10)9-14)15-16(5,6)13(2,3)4/h12,14H,7-9H2,1-6H3.
What are the key properties of [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol?
[5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol has a molecular weight of 242.43 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol is sourced from PubChem (CID 11118241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).