tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane

C14H28OSi — CID 59483139

IUPACtert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane
SMILESCC1C=C[C@@H](CO[Si](C)(C)C(C)(C)C)[C@@H]1C
InChIInChI=1S/C14H28OSi/c1-11-8-9-13(12(11)2)10-15-16(6,7)14(3,4)5/h8-9,11-13H,10H2,1-7H3/t11?,12-,13+/m1/s1
InChIKeyCTGHTPHKYYPDCE-HDYSRYHKSA-N
MW240.46 g/mol
LogP4.47
Rot. Bonds3

About tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane

tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane (PubChem CID 59483139) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane
PubChem CID59483139
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Nametert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane
SMILESCC1C=C[C@@H](CO[Si](C)(C)C(C)(C)C)[C@@H]1C
InChIInChI=1S/C14H28OSi/c1-11-8-9-13(12(11)2)10-15-16(6,7)14(3,4)5/h8-9,11-13H,10H2,1-7H3/t11?,12-,13+/m1/s1
InChIKeyCTGHTPHKYYPDCE-HDYSRYHKSA-N
XLogP4.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane (CID 59483139) is tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane is CC1C=C[C@@H](CO[Si](C)(C)C(C)(C)C)[C@@H]1C.
What is the InChIKey of tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane?
The InChIKey is CTGHTPHKYYPDCE-HDYSRYHKSA-N. The full InChI is InChI=1S/C14H28OSi/c1-11-8-9-13(12(11)2)10-15-16(6,7)14(3,4)5/h8-9,11-13H,10H2,1-7H3/t11?,12-,13+/m1/s1.
What are the key properties of tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane?
tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane has a molecular weight of 240.46 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(1R,5R)-4,5-dimethylcyclopent-2-en-1-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 59483139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).