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

C16H30OSi — CID 173198640

IUPAC1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane
SMILESCCC[SiH](CCC)OC(C)CC1CC2C=CC1C2
InChIInChI=1S/C16H30OSi/c1-4-8-18(9-5-2)17-13(3)10-16-12-14-6-7-15(16)11-14/h6-7,13-16,18H,4-5,8-12H2,1-3H3
InChIKeyVBNRZENYQYAFLL-UHFFFAOYSA-N
MW266.50 g/mol
LogP4.54
Rot. Bonds8

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

1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane (PubChem CID 173198640) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane
PubChem CID173198640
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Name1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane
SMILESCCC[SiH](CCC)OC(C)CC1CC2C=CC1C2
InChIInChI=1S/C16H30OSi/c1-4-8-18(9-5-2)17-13(3)10-16-12-14-6-7-15(16)11-14/h6-7,13-16,18H,4-5,8-12H2,1-3H3
InChIKeyVBNRZENYQYAFLL-UHFFFAOYSA-N
XLogP4.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.50
LogP ≤ 54.54
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-dipropylsilane?
The IUPAC name of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane (CID 173198640) is 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane?
The canonical SMILES for 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane is CCC[SiH](CCC)OC(C)CC1CC2C=CC1C2.
What is the InChIKey of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane?
The InChIKey is VBNRZENYQYAFLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-4-8-18(9-5-2)17-13(3)10-16-12-14-6-7-15(16)11-14/h6-7,13-16,18H,4-5,8-12H2,1-3H3.
What are the key properties of 1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane?
1-(2-bicyclo[2.2.1]hept-5-enyl)propan-2-yloxy-dipropylsilane has a molecular weight of 266.50 g/mol, XLogP of 4.54, 8 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-dipropylsilane is sourced from PubChem (CID 173198640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).