1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane

C14H26OSi — CID 173198615

IUPAC1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane
SMILESCC[SiH](CC)OC(C)CC1CC2C=CC1C2
InChIInChI=1S/C14H26OSi/c1-4-16(5-2)15-11(3)8-14-10-12-6-7-13(14)9-12/h6-7,11-14,16H,4-5,8-10H2,1-3H3
InChIKeyPZSPYIXCPKWLKX-UHFFFAOYSA-N
MW238.45 g/mol
LogP3.76
Rot. Bonds6

About 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane

1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane (PubChem CID 173198615) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane
PubChem CID173198615
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane
SMILESCC[SiH](CC)OC(C)CC1CC2C=CC1C2
InChIInChI=1S/C14H26OSi/c1-4-16(5-2)15-11(3)8-14-10-12-6-7-13(14)9-12/h6-7,11-14,16H,4-5,8-10H2,1-3H3
InChIKeyPZSPYIXCPKWLKX-UHFFFAOYSA-N
XLogP3.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 53.76
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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Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane?
The IUPAC name of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane (CID 173198615) is 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane?
The canonical SMILES for 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane is CC[SiH](CC)OC(C)CC1CC2C=CC1C2.
What is the InChIKey of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane?
The InChIKey is PZSPYIXCPKWLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26OSi/c1-4-16(5-2)15-11(3)8-14-10-12-6-7-13(14)9-12/h6-7,11-14,16H,4-5,8-10H2,1-3H3.
What are the key properties of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane?
1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane has a molecular weight of 238.45 g/mol, XLogP of 3.76, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-diethylsilane is sourced from PubChem (CID 173198615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).