[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane

C7H9F3Si — CID 134992014

IUPAC[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane
SMILESF[Si](F)(F)[C@H]1C[C@@H]2C=C[C@H]1C2
InChIInChI=1S/C7H9F3Si/c8-11(9,10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2/t5-,6+,7+/m1/s1
InChIKeyKAVMOGBCKRXUMG-VQVTYTSYSA-N
MW178.23 g/mol
LogP2.80
Rot. Bonds1

About [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane

[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane (PubChem CID 134992014) has the molecular formula C7H9F3Si and a molecular weight of 178.23 g/mol. Its IUPAC name is [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane.

Molecular Properties

Compound Name[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane
PubChem CID134992014
Molecular FormulaC7H9F3Si
Molecular Weight178.23 g/mol
Exact Mass178.04
IUPAC Name[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane
SMILESF[Si](F)(F)[C@H]1C[C@@H]2C=C[C@H]1C2
InChIInChI=1S/C7H9F3Si/c8-11(9,10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2/t5-,6+,7+/m1/s1
InChIKeyKAVMOGBCKRXUMG-VQVTYTSYSA-N
XLogP2.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.80
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

Bicyclo[2.2.1]hept-5-en-2-yltrichlorosilane
CID 548689
5-(Bicycloheptenyl)trichlorosilane
CID 11651523
Silane, triethyl-5-norbornen-2-yl-
CID 574755
Silane, bicyclo[2.2.1]hept-5-en-2-yltrimethyl-
CID 10329681
[(1S,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane
CID 134979763
Silylnorbornene
CID 22228902
(Trichlorosilyl)norbornene
CID 22325799
Trimethylsilylnorbornene
CID 66700380
5,5-Difluorobicyclo[2.2.1]hept-2-ene
CID 21946932
5,6-Difluorobicyclo[2.2.1]hept-2-ene
CID 21960493
2-Bicyclo[2.2.1]hept-5-enyl(trifluoro)silane
CID 22388819
7,7-Difluorobicyclo[2.2.1]hept-2-ene
CID 53438666

Frequently Asked Questions

What is the IUPAC name of [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane?
The IUPAC name of [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane (CID 134992014) is [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane.
What is the SMILES notation for [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane?
The canonical SMILES for [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane is F[Si](F)(F)[C@H]1C[C@@H]2C=C[C@H]1C2.
What is the InChIKey of [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane?
The InChIKey is KAVMOGBCKRXUMG-VQVTYTSYSA-N. The full InChI is InChI=1S/C7H9F3Si/c8-11(9,10)7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2/t5-,6+,7+/m1/s1.
What are the key properties of [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane?
[(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane has a molecular weight of 178.23 g/mol, XLogP of 2.80, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S,4R)-2-bicyclo[2.2.1]hept-5-enyl]-trifluorosilane is sourced from PubChem (CID 134992014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).