2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane

C13H24Si — CID 22229006

IUPAC2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane
SMILESCC(C)[Si](C)(C)CC1CC2C=CC1C2
InChIInChI=1S/C13H24Si/c1-10(2)14(3,4)9-13-8-11-5-6-12(13)7-11/h5-6,10-13H,7-9H2,1-4H3
InChIKeyPBBIGBLPJPLTRK-UHFFFAOYSA-N
MW208.42 g/mol
LogP4.32
Rot. Bonds3

About 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane

2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane (PubChem CID 22229006) has the molecular formula C13H24Si and a molecular weight of 208.42 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane
PubChem CID22229006
Molecular FormulaC13H24Si
Molecular Weight208.42 g/mol
Exact Mass208.16
IUPAC Name2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane
SMILESCC(C)[Si](C)(C)CC1CC2C=CC1C2
InChIInChI=1S/C13H24Si/c1-10(2)14(3,4)9-13-8-11-5-6-12(13)7-11/h5-6,10-13H,7-9H2,1-4H3
InChIKeyPBBIGBLPJPLTRK-UHFFFAOYSA-N
XLogP4.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.42
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane (CID 22229006) is 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane is CC(C)[Si](C)(C)CC1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane?
The InChIKey is PBBIGBLPJPLTRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24Si/c1-10(2)14(3,4)9-13-8-11-5-6-12(13)7-11/h5-6,10-13H,7-9H2,1-4H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane?
2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane has a molecular weight of 208.42 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enylmethyl-dimethyl-propan-2-ylsilane is sourced from PubChem (CID 22229006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).