2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane

C11H18OSi — CID 173166436

IUPAC2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane
SMILESC/C=C(\C)[SiH2]OC1=CC2CCC1C2
InChIInChI=1S/C11H18OSi/c1-3-8(2)13-12-11-7-9-4-5-10(11)6-9/h3,7,9-10H,4-6,13H2,1-2H3/b8-3+
InChIKeyVJTFWTURIKCRPH-FPYGCLRLSA-N
MW194.35 g/mol
LogP2.32
Rot. Bonds3

About 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane

2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane (PubChem CID 173166436) has the molecular formula C11H18OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane
PubChem CID173166436
Molecular FormulaC11H18OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Name2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane
SMILESC/C=C(\C)[SiH2]OC1=CC2CCC1C2
InChIInChI=1S/C11H18OSi/c1-3-8(2)13-12-11-7-9-4-5-10(11)6-9/h3,7,9-10H,4-6,13H2,1-2H3/b8-3+
InChIKeyVJTFWTURIKCRPH-FPYGCLRLSA-N
XLogP2.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 52.32
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 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane (CID 173166436) is 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane is C/C=C(\C)[SiH2]OC1=CC2CCC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane?
The InChIKey is VJTFWTURIKCRPH-FPYGCLRLSA-N. The full InChI is InChI=1S/C11H18OSi/c1-3-8(2)13-12-11-7-9-4-5-10(11)6-9/h3,7,9-10H,4-6,13H2,1-2H3/b8-3+.
What are the key properties of 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane?
2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane has a molecular weight of 194.35 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-2-enyloxy-[(E)-but-2-en-2-yl]silane is sourced from PubChem (CID 173166436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).