1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane

C12H18OSi — CID 10822184

IUPAC1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane
SMILESC=C(O[Si](C)(C)C)C1=CC=CC=CC1
InChIInChI=1S/C12H18OSi/c1-11(13-14(2,3)4)12-9-7-5-6-8-10-12/h5-9H,1,10H2,2-4H3
InChIKeyNJAQLWANQCZFOR-UHFFFAOYSA-N
MW206.36 g/mol
LogP3.79
Rot. Bonds3

About 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane

1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane (PubChem CID 10822184) has the molecular formula C12H18OSi and a molecular weight of 206.36 g/mol. Its IUPAC name is 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane.

Molecular Properties

Compound Name1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane
PubChem CID10822184
Molecular FormulaC12H18OSi
Molecular Weight206.36 g/mol
Exact Mass206.11
IUPAC Name1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane
SMILESC=C(O[Si](C)(C)C)C1=CC=CC=CC1
InChIInChI=1S/C12H18OSi/c1-11(13-14(2,3)4)12-9-7-5-6-8-10-12/h5-9H,1,10H2,2-4H3
InChIKeyNJAQLWANQCZFOR-UHFFFAOYSA-N
XLogP3.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-(Trimethylsiloxy)-1,3-cyclohexadiene
CID 4095656
(E)-trimethyl(nona-1,3-dien-2-yloxy)silane
CID 86668734
Tert-butyl-dimethyl-(2-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 11064098
Tert-butyl-cyclohexa-1,5-dien-1-yloxy-dimethylsilane
CID 11042035
trimethyl-[(3E)-5-methylhexa-1,3-dien-2-yl]oxysilane
CID 11183042
Silane, trimethyl[(5-methyl-1,5-cyclohexadien-1-yl)oxy]-
CID 11229158
(3-Cyclopropylideneprop-1-en-2-yloxy)trimethylsilane
CID 15174784
Trimethyl[(6-methylhepta-1,5-dien-2-YL)oxy]silane
CID 12579603
Cyclohepta-1,6-dien-1-yloxy(trimethyl)silane
CID 13308700
(E)-trimethyl(3-methylpenta-1,3-dien-2-yloxy)silane
CID 13660030
trimethyl-[(3E,8E)-9-methylundeca-1,3,8,10-tetraen-5-yl]oxysilane
CID 10658360
trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
CID 11275650

Frequently Asked Questions

What is the IUPAC name of 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane?
The IUPAC name of 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane (CID 10822184) is 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane.
What is the SMILES notation for 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane?
The canonical SMILES for 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane is C=C(O[Si](C)(C)C)C1=CC=CC=CC1.
What is the InChIKey of 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane?
The InChIKey is NJAQLWANQCZFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18OSi/c1-11(13-14(2,3)4)12-9-7-5-6-8-10-12/h5-9H,1,10H2,2-4H3.
What are the key properties of 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane?
1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane has a molecular weight of 206.36 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohepta-1,3,5-trien-1-ylethenoxy(trimethyl)silane is sourced from PubChem (CID 10822184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).