tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane

C17H34OSi2 — CID 135042299

IUPACtert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane
SMILESC=C(C1=CC[C@@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H34OSi2/c1-13-11-12-15(14(2)19(6,7)8)16(13)18-20(9,10)17(3,4)5/h12-13,16H,2,11H2,1,3-10H3/t13-,16+/m1/s1
InChIKeyJDXCAMZPPPYOGC-CJNGLKHVSA-N
MW310.63 g/mol
LogP5.78
Rot. Bonds4

About tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane

tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane (PubChem CID 135042299) has the molecular formula C17H34OSi2 and a molecular weight of 310.63 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane
PubChem CID135042299
Molecular FormulaC17H34OSi2
Molecular Weight310.63 g/mol
Exact Mass310.21
IUPAC Nametert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane
SMILESC=C(C1=CC[C@@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H34OSi2/c1-13-11-12-15(14(2)19(6,7)8)16(13)18-20(9,10)17(3,4)5/h12-13,16H,2,11H2,1,3-10H3/t13-,16+/m1/s1
InChIKeyJDXCAMZPPPYOGC-CJNGLKHVSA-N
XLogP5.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.63
LogP ≤ 55.78
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-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane (CID 135042299) is tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane is C=C(C1=CC[C@@H](C)[C@@H]1O[Si](C)(C)C(C)(C)C)[Si](C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane?
The InChIKey is JDXCAMZPPPYOGC-CJNGLKHVSA-N. The full InChI is InChI=1S/C17H34OSi2/c1-13-11-12-15(14(2)19(6,7)8)16(13)18-20(9,10)17(3,4)5/h12-13,16H,2,11H2,1,3-10H3/t13-,16+/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane?
tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane has a molecular weight of 310.63 g/mol, XLogP of 5.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1S,5R)-5-methyl-2-(1-trimethylsilylethenyl)cyclopent-2-en-1-yl]oxysilane is sourced from PubChem (CID 135042299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).