tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane

C21H26OSi — CID 11347853

IUPACtert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane
SMILESCC(C)(C)[Si](OC1CC=CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26OSi/c1-21(2,3)23(19-14-6-4-7-15-19,20-16-8-5-9-17-20)22-18-12-10-11-13-18/h4-11,14-18H,12-13H2,1-3H3
InChIKeyGCODZQWZNXYLIA-UHFFFAOYSA-N
MW322.52 g/mol
LogP4.28
Rot. Bonds4

About tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane

tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane (PubChem CID 11347853) has the molecular formula C21H26OSi and a molecular weight of 322.52 g/mol. Its IUPAC name is tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane
PubChem CID11347853
Molecular FormulaC21H26OSi
Molecular Weight322.52 g/mol
Exact Mass322.18
IUPAC Nametert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane
SMILESCC(C)(C)[Si](OC1CC=CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26OSi/c1-21(2,3)23(19-14-6-4-7-15-19,20-16-8-5-9-17-20)22-18-12-10-11-13-18/h4-11,14-18H,12-13H2,1-3H3
InChIKeyGCODZQWZNXYLIA-UHFFFAOYSA-N
XLogP4.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.52
LogP ≤ 54.28
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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Related Compounds

3-bicyclo[3.1.0]hexanyloxy-tert-butyl-diphenylsilane
CID 154401251
3-[tert-butyl(diphenyl)silyl]oxycyclobutan-1-ol
CID 59414974
(3-bromocyclobutyl)oxy-tert-butyl-diphenylsilane
CID 142577121
tert-butyl-[[(3R)-1-oxido-3,4-dihydro-2H-pyrrol-1-ium-3-yl]oxy]-diphenylsilane
CID 15427815
4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine
CID 142751894
tert-butyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-6-en-3-yl]oxy]-diphenylsilane
CID 102008296
tert-butyl-diphenyl-[(3R)-pyrrolidin-3-yl]oxysilane
CID 58393504
4-[tert-butyl(diphenyl)silyl]oxycyclopentane-1,2-diamine;4-[tert-butyl(diphenyl)silyl]oxycyclopentane-1,2-diol
CID 159197453
(1S,2R,4R)-4-[tert-butyl(diphenyl)silyl]oxycyclohexane-1,2-diamine
CID 177070919
2-[(2R,6R)-4-[tert-butyl(diphenyl)silyl]oxy-6-(2-hydroxypropan-2-yl)oxan-2-yl]propan-2-ol
CID 11977280
1-[(1R,5R)-3-[tert-butyl(diphenyl)silyl]oxy-6-bicyclo[3.1.0]hexanyl]ethanone
CID 129323384
(4R)-4-[tert-butyl(diphenyl)silyl]oxy-1-methylpyrrolidin-2-one
CID 171692304

Frequently Asked Questions

What is the IUPAC name of tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane?
The IUPAC name of tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane (CID 11347853) is tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane.
What is the SMILES notation for tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane?
The canonical SMILES for tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane is CC(C)(C)[Si](OC1CC=CC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane?
The InChIKey is GCODZQWZNXYLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26OSi/c1-21(2,3)23(19-14-6-4-7-15-19,20-16-8-5-9-17-20)22-18-12-10-11-13-18/h4-11,14-18H,12-13H2,1-3H3.
What are the key properties of tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane?
tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane has a molecular weight of 322.52 g/mol, XLogP of 4.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane is sourced from PubChem (CID 11347853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).