[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol

C13H26O2Si — CID 173298698

IUPAC[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol
SMILESC[SiH](C)OCC1=C(CO)C(C(C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-13(2,3)12-7-6-10(11(12)8-14)9-15-16(4)5/h12,14,16H,6-9H2,1-5H3
InChIKeyVIWDOZVDLJOBMA-UHFFFAOYSA-N
MW242.43 g/mol
LogP2.73
Rot. Bonds4

About [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol

[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol (PubChem CID 173298698) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol.

Molecular Properties

Compound Name[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol
PubChem CID173298698
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol
SMILESC[SiH](C)OCC1=C(CO)C(C(C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-13(2,3)12-7-6-10(11(12)8-14)9-15-16(4)5/h12,14,16H,6-9H2,1-5H3
InChIKeyVIWDOZVDLJOBMA-UHFFFAOYSA-N
XLogP2.73
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 52.73
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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Frequently Asked Questions

What is the IUPAC name of [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol?
The IUPAC name of [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol (CID 173298698) is [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol.
What is the SMILES notation for [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol?
The canonical SMILES for [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol is C[SiH](C)OCC1=C(CO)C(C(C)(C)C)CC1.
What is the InChIKey of [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol?
The InChIKey is VIWDOZVDLJOBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-13(2,3)12-7-6-10(11(12)8-14)9-15-16(4)5/h12,14,16H,6-9H2,1-5H3.
What are the key properties of [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol?
[5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol has a molecular weight of 242.43 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-tert-butyl-2-(dimethylsilyloxymethyl)cyclopenten-1-yl]methanol is sourced from PubChem (CID 173298698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).