ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate

C15H28O3Si — CID 14435493

IUPACethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate
SMILESCCOC(=O)/C=C1/CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H28O3Si/c1-7-17-14(16)11-12-9-8-10-13(12)18-19(5,6)15(2,3)4/h11,13H,7-10H2,1-6H3/b12-11-
InChIKeyQCOFBHMZPKCIKC-QXMHVHEDSA-N
MW284.47 g/mol
LogP4.05
Rot. Bonds4

About ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate

ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate (PubChem CID 14435493) has the molecular formula C15H28O3Si and a molecular weight of 284.47 g/mol. Its IUPAC name is ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate.

Molecular Properties

Compound Nameethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate
PubChem CID14435493
Molecular FormulaC15H28O3Si
Molecular Weight284.47 g/mol
Exact Mass284.18
IUPAC Nameethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate
SMILESCCOC(=O)/C=C1/CCCC1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H28O3Si/c1-7-17-14(16)11-12-9-8-10-13(12)18-19(5,6)15(2,3)4/h11,13H,7-10H2,1-6H3/b12-11-
InChIKeyQCOFBHMZPKCIKC-QXMHVHEDSA-N
XLogP4.05
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.47
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate?
The IUPAC name of ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate (CID 14435493) is ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate.
What is the SMILES notation for ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate?
The canonical SMILES for ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate is CCOC(=O)/C=C1/CCCC1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate?
The InChIKey is QCOFBHMZPKCIKC-QXMHVHEDSA-N. The full InChI is InChI=1S/C15H28O3Si/c1-7-17-14(16)11-12-9-8-10-13(12)18-19(5,6)15(2,3)4/h11,13H,7-10H2,1-6H3/b12-11-.
What are the key properties of ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate?
ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate has a molecular weight of 284.47 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2Z)-2-[2-[tert-butyl(dimethyl)silyl]oxycyclopentylidene]acetate is sourced from PubChem (CID 14435493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).