tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane

C16H30OSi — CID 101342104

IUPACtert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane
SMILESC=C1/C(=C/C)CC(C)(C)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-10-13-11-16(6,7)14(12(13)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/b13-10+
InChIKeyDGRDLIIIXOYAME-JLHYYAGUSA-N
MW266.50 g/mol
LogP5.31
Rot. Bonds2

About tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane

tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane (PubChem CID 101342104) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane
PubChem CID101342104
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane
SMILESC=C1/C(=C/C)CC(C)(C)C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-10-13-11-16(6,7)14(12(13)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/b13-10+
InChIKeyDGRDLIIIXOYAME-JLHYYAGUSA-N
XLogP5.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.31
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 tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane (CID 101342104) is tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane is C=C1/C(=C/C)CC(C)(C)C1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane?
The InChIKey is DGRDLIIIXOYAME-JLHYYAGUSA-N. The full InChI is InChI=1S/C16H30OSi/c1-10-13-11-16(6,7)14(12(13)2)17-18(8,9)15(3,4)5/h10,14H,2,11H2,1,3-9H3/b13-10+.
What are the key properties of tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane?
tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane has a molecular weight of 266.50 g/mol, XLogP of 5.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4E)-4-ethylidene-2,2-dimethyl-5-methylidenecyclopentyl]oxy-dimethylsilane is sourced from PubChem (CID 101342104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).