triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane

C16H29FOSi — CID 22908409

IUPACtriethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane
SMILESC=C1CC(O[Si](CC)(CC)CC)C(C)=C1CCCF
InChIInChI=1S/C16H29FOSi/c1-6-19(7-2,8-3)18-16-12-13(4)15(14(16)5)10-9-11-17/h16H,4,6-12H2,1-3,5H3
InChIKeyDOBXOLMECIVWQO-UHFFFAOYSA-N
MW284.49 g/mol
LogP5.40
Rot. Bonds8

About triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane

triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane (PubChem CID 22908409) has the molecular formula C16H29FOSi and a molecular weight of 284.49 g/mol. Its IUPAC name is triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane
PubChem CID22908409
Molecular FormulaC16H29FOSi
Molecular Weight284.49 g/mol
Exact Mass284.20
IUPAC Nametriethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane
SMILESC=C1CC(O[Si](CC)(CC)CC)C(C)=C1CCCF
InChIInChI=1S/C16H29FOSi/c1-6-19(7-2,8-3)18-16-12-13(4)15(14(16)5)10-9-11-17/h16H,4,6-12H2,1-3,5H3
InChIKeyDOBXOLMECIVWQO-UHFFFAOYSA-N
XLogP5.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.49
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane?
The IUPAC name of triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane (CID 22908409) is triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane.
What is the SMILES notation for triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane?
The canonical SMILES for triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane is C=C1CC(O[Si](CC)(CC)CC)C(C)=C1CCCF.
What is the InChIKey of triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane?
The InChIKey is DOBXOLMECIVWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29FOSi/c1-6-19(7-2,8-3)18-16-12-13(4)15(14(16)5)10-9-11-17/h16H,4,6-12H2,1-3,5H3.
What are the key properties of triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane?
triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane has a molecular weight of 284.49 g/mol, XLogP of 5.40, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[3-(3-fluoropropyl)-2-methyl-4-methylidenecyclopent-2-en-1-yl]oxysilane is sourced from PubChem (CID 22908409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).