1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol

C15H30O3Si — CID 102184988

IUPAC1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol
SMILESCC(O)C1=C(C(C)O)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C15H30O3Si/c1-10(16)12-8-9-13(14(12)11(2)17)18-19(6,7)15(3,4)5/h10-11,13,16-17H,8-9H2,1-7H3
InChIKeyJBESZMBQCBHKDV-UHFFFAOYSA-N
MW286.49 g/mol
LogP3.23
Rot. Bonds4

About 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol

1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol (PubChem CID 102184988) has the molecular formula C15H30O3Si and a molecular weight of 286.49 g/mol. Its IUPAC name is 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol.

Molecular Properties

Compound Name1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol
PubChem CID102184988
Molecular FormulaC15H30O3Si
Molecular Weight286.49 g/mol
Exact Mass286.20
IUPAC Name1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol
SMILESCC(O)C1=C(C(C)O)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C15H30O3Si/c1-10(16)12-8-9-13(14(12)11(2)17)18-19(6,7)15(3,4)5/h10-11,13,16-17H,8-9H2,1-7H3
InChIKeyJBESZMBQCBHKDV-UHFFFAOYSA-N
XLogP3.23
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.49
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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
[4-[Tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
CID 16115547
5-[Tert-butyl(dimethyl)silyl]oxy-1-(cyclohepten-1-yl)pentan-1-ol
CID 24795825
[(3S)-3-[tert-butyl(dimethyl)silyl]oxycyclopenten-1-yl]methanol
CID 46193781
(1R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohex-2-en-1-ol
CID 101808796
[6-[Tert-butyl(dimethyl)silyl]oxycyclohexen-1-yl]methanol
CID 134965784
(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
(1S)-5-[tert-butyl(dimethyl)silyl]oxy-1-(cyclohexen-1-yl)pentan-1-ol
CID 10518216
[5-[Tert-butyl(dimethyl)silyl]oxy-2-methylcyclopenten-1-yl]methanol
CID 11118241
4-[Tert-butyl(dimethyl)silyl]oxy-3-[7-[tert-butyl(dimethyl)silyl]oxyheptyl]cyclopent-2-en-1-ol
CID 13216823

Frequently Asked Questions

What is the IUPAC name of 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol?
The IUPAC name of 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol (CID 102184988) is 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol.
What is the SMILES notation for 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol?
The canonical SMILES for 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol is CC(O)C1=C(C(C)O)C(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol?
The InChIKey is JBESZMBQCBHKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O3Si/c1-10(16)12-8-9-13(14(12)11(2)17)18-19(6,7)15(3,4)5/h10-11,13,16-17H,8-9H2,1-7H3.
What are the key properties of 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol?
1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol has a molecular weight of 286.49 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[tert-butyl(dimethyl)silyl]oxy-2-(1-hydroxyethyl)cyclopenten-1-yl]ethanol is sourced from PubChem (CID 102184988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).