(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one

C15H26O3Si — CID 10924032

IUPAC(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one
SMILESC=CCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C=CC(=O)O1
InChIInChI=1S/C15H26O3Si/c1-7-8-9-13(12-10-11-14(16)17-12)18-19(5,6)15(2,3)4/h7,10-13H,1,8-9H2,2-6H3/t12-,13-/m1/s1
InChIKeyJIHLNDZUWOGQJJ-CHWSQXEVSA-N
MW282.46 g/mol
LogP3.82
Rot. Bonds6

About (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one

(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one (PubChem CID 10924032) has the molecular formula C15H26O3Si and a molecular weight of 282.46 g/mol. Its IUPAC name is (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one
PubChem CID10924032
Molecular FormulaC15H26O3Si
Molecular Weight282.46 g/mol
Exact Mass282.17
IUPAC Name(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one
SMILESC=CCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C=CC(=O)O1
InChIInChI=1S/C15H26O3Si/c1-7-8-9-13(12-10-11-14(16)17-12)18-19(5,6)15(2,3)4/h7,10-13H,1,8-9H2,2-6H3/t12-,13-/m1/s1
InChIKeyJIHLNDZUWOGQJJ-CHWSQXEVSA-N
XLogP3.82
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.46
LogP ≤ 53.82
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one?
The IUPAC name of (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one (CID 10924032) is (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one.
What is the SMILES notation for (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one?
The canonical SMILES for (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one is C=CCC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C=CC(=O)O1.
What is the InChIKey of (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one?
The InChIKey is JIHLNDZUWOGQJJ-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H26O3Si/c1-7-8-9-13(12-10-11-14(16)17-12)18-19(5,6)15(2,3)4/h7,10-13H,1,8-9H2,2-6H3/t12-,13-/m1/s1.
What are the key properties of (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one?
(2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one has a molecular weight of 282.46 g/mol, XLogP of 3.82, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypent-4-enyl]-2H-furan-5-one is sourced from PubChem (CID 10924032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).