2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane

C16H30OSi — CID 22229016

IUPAC2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane
SMILESCCO[Si](CC1CC2C=CC1C2)(C(C)C)C(C)C
InChIInChI=1S/C16H30OSi/c1-6-17-18(12(2)3,13(4)5)11-16-10-14-7-8-15(16)9-14/h7-8,12-16H,6,9-11H2,1-5H3
InChIKeyOKWXEGVPTLCCSA-UHFFFAOYSA-N
MW266.50 g/mol
LogP5.00
Rot. Bonds6

About 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane

2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane (PubChem CID 22229016) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane
PubChem CID22229016
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Name2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane
SMILESCCO[Si](CC1CC2C=CC1C2)(C(C)C)C(C)C
InChIInChI=1S/C16H30OSi/c1-6-17-18(12(2)3,13(4)5)11-16-10-14-7-8-15(16)9-14/h7-8,12-16H,6,9-11H2,1-5H3
InChIKeyOKWXEGVPTLCCSA-UHFFFAOYSA-N
XLogP5.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.00
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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Related Compounds

2-bicyclo[2.2.1]hept-5-enylmethoxy-tri(propan-2-yl)silane
CID 100919043
2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-dipropylsilane
CID 22229061
2-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-triethoxysilane
CID 124925724
5-(2-methylpropyl)bicyclo[2.2.1]hept-2-ene
CID 21079931
(1S,4S,5R)-5-ethylbicyclo[2.2.1]hept-2-ene
CID 96570682
2-bicyclo[2.2.1]hept-5-enylmethanol;hydroperoxyethane
CID 87177397
2-bicyclo[2.2.1]hept-5-enyl-diethoxy-methylsilane
CID 14985012
[(1S,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]methoxy-tert-butyl-dimethylsilane
CID 11436362
5-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]bicyclo[2.2.1]hept-2-ene
CID 160903518
[(1R,4R)-2-bicyclo[2.2.1]hept-5-enyl]methoxy-dimethylalumane
CID 16687358
2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane
CID 176549494
CID 22228993
CID 22228993

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane (CID 22229016) is 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane is CCO[Si](CC1CC2C=CC1C2)(C(C)C)C(C)C.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane?
The InChIKey is OKWXEGVPTLCCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-6-17-18(12(2)3,13(4)5)11-16-10-14-7-8-15(16)9-14/h7-8,12-16H,6,9-11H2,1-5H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane?
2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane has a molecular weight of 266.50 g/mol, XLogP of 5.00, 6 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-5-enylmethyl-ethoxy-di(propan-2-yl)silane is sourced from PubChem (CID 22229016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).