cyclopentyl 2-dimethylsilylpentanoate

C12H24O2Si — CID 174709908

IUPACcyclopentyl 2-dimethylsilylpentanoate
SMILESCCCC(C(=O)OC1CCCC1)[SiH](C)C
InChIInChI=1S/C12H24O2Si/c1-4-7-11(15(2)3)12(13)14-10-8-5-6-9-10/h10-11,15H,4-9H2,1-3H3
InChIKeyKMQFGOCLOXZIJT-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.13
Rot. Bonds5

About cyclopentyl 2-dimethylsilylpentanoate

cyclopentyl 2-dimethylsilylpentanoate (PubChem CID 174709908) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is cyclopentyl 2-dimethylsilylpentanoate.

Molecular Properties

Compound Namecyclopentyl 2-dimethylsilylpentanoate
PubChem CID174709908
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Namecyclopentyl 2-dimethylsilylpentanoate
SMILESCCCC(C(=O)OC1CCCC1)[SiH](C)C
InChIInChI=1S/C12H24O2Si/c1-4-7-11(15(2)3)12(13)14-10-8-5-6-9-10/h10-11,15H,4-9H2,1-3H3
InChIKeyKMQFGOCLOXZIJT-UHFFFAOYSA-N
XLogP3.13
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl 2-dimethylsilylpentanoate?
The IUPAC name of cyclopentyl 2-dimethylsilylpentanoate (CID 174709908) is cyclopentyl 2-dimethylsilylpentanoate.
What is the SMILES notation for cyclopentyl 2-dimethylsilylpentanoate?
The canonical SMILES for cyclopentyl 2-dimethylsilylpentanoate is CCCC(C(=O)OC1CCCC1)[SiH](C)C.
What is the InChIKey of cyclopentyl 2-dimethylsilylpentanoate?
The InChIKey is KMQFGOCLOXZIJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-4-7-11(15(2)3)12(13)14-10-8-5-6-9-10/h10-11,15H,4-9H2,1-3H3.
What are the key properties of cyclopentyl 2-dimethylsilylpentanoate?
cyclopentyl 2-dimethylsilylpentanoate has a molecular weight of 228.41 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl 2-dimethylsilylpentanoate is sourced from PubChem (CID 174709908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).