trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane

C13H22OSi — CID 13360372

IUPACtrimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane
SMILESC=C(C)[C@H]1C=C(O[Si](C)(C)C)C(C)=CC1
InChIInChI=1S/C13H22OSi/c1-10(2)12-8-7-11(3)13(9-12)14-15(4,5)6/h7,9,12H,1,8H2,2-6H3/t12-/m1/s1
InChIKeyJDANSBUFJJUXTK-GFCCVEGCSA-N
MW222.40 g/mol
LogP4.26
Rot. Bonds3

About trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane

trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane (PubChem CID 13360372) has the molecular formula C13H22OSi and a molecular weight of 222.40 g/mol. Its IUPAC name is trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane
PubChem CID13360372
Molecular FormulaC13H22OSi
Molecular Weight222.40 g/mol
Exact Mass222.14
IUPAC Nametrimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane
SMILESC=C(C)[C@H]1C=C(O[Si](C)(C)C)C(C)=CC1
InChIInChI=1S/C13H22OSi/c1-10(2)12-8-7-11(3)13(9-12)14-15(4,5)6/h7,9,12H,1,8H2,2-6H3/t12-/m1/s1
InChIKeyJDANSBUFJJUXTK-GFCCVEGCSA-N
XLogP4.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.40
LogP ≤ 54.26
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

Tert-butyl-dimethyl-(2-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 11064098
Silane, trimethyl[(5-methyl-1,5-cyclohexadien-1-yl)oxy]-
CID 11229158
Tert-butyl-dimethyl-(5-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13499167
trimethyl-[(5S)-2-methyl-5-prop-1-en-2-ylcyclohexa-1,3-dien-1-yl]oxysilane
CID 89219095
Tert-butyl-(2-fluoro-3-methylcyclohexa-1,5-dien-1-yl)oxy-dimethylsilane
CID 173932547
Trimethyl-(3-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13448214
Silane, trimethyl[(3,3,5-trimethyl-1,5-cyclohexadien-1-yl)oxy]-
CID 11106647
trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
CID 11275650
(5,6-Dimethylcyclohexa-1,5-dien-1-yl)oxy-trimethylsilane
CID 12453980
Trimethyl-(6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13360371
Tert-butyl-dimethyl-(6-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13499166
Tert-butyl-dimethyl-(4-prop-2-enylcyclohexa-1,5-dien-1-yl)oxysilane
CID 91574746

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane?
The IUPAC name of trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane (CID 13360372) is trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane.
What is the SMILES notation for trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane?
The canonical SMILES for trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane is C=C(C)[C@H]1C=C(O[Si](C)(C)C)C(C)=CC1.
What is the InChIKey of trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane?
The InChIKey is JDANSBUFJJUXTK-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H22OSi/c1-10(2)12-8-7-11(3)13(9-12)14-15(4,5)6/h7,9,12H,1,8H2,2-6H3/t12-/m1/s1.
What are the key properties of trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane?
trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane has a molecular weight of 222.40 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3R)-6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl]oxysilane is sourced from PubChem (CID 13360372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).