2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane

C9H15ClSi — CID 56996028

IUPAC2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)C1CC2=CCC1C2
InChIInChI=1S/C9H15ClSi/c1-11(2,10)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3
InChIKeyJOSYJXSUYXXHDM-UHFFFAOYSA-N
MW186.76 g/mol
LogP3.54
Rot. Bonds1

About 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane

2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane (PubChem CID 56996028) has the molecular formula C9H15ClSi and a molecular weight of 186.76 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane
PubChem CID56996028
Molecular FormulaC9H15ClSi
Molecular Weight186.76 g/mol
Exact Mass186.06
IUPAC Name2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane
SMILESC[Si](C)(Cl)C1CC2=CCC1C2
InChIInChI=1S/C9H15ClSi/c1-11(2,10)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3
InChIKeyJOSYJXSUYXXHDM-UHFFFAOYSA-N
XLogP3.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.76
LogP ≤ 53.54
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-2-ene, 5-(dichloromethylsilyl)-
CID 86686
5-Chloro(dimethyl)silylnorbornene
CID 548778
Silane, bicyclo[2.2.1]hept-2-en-2-yltrimethyl-
CID 552419
Norbornenylethyldimethylchlorosilane
CID 22388891
1-Trimethylsilylmethyl-4-methylcyclohexene
CID 23264754
Ethylsilylnorbornene
CID 129773643
dichloro-[(Z)-1-cyclopentyl-2-methylbut-2-enyl]-methylsilane
CID 134900690
Trimethyl-[2-(4-methylcyclohex-3-en-1-yl)prop-2-enyl]silane
CID 134978770
1-Trimethylsilylmethyl-4-isopropenylcyclohexene
CID 10656000
[(1S,4R)-2-bicyclo[2.2.1]hept-2-enyl]-trimethylsilane
CID 101103577
trimethyl-[2-[(2E)-2-pentylidenecyclopentyl]ethyl]silane
CID 102356643
Trimethyl[(4-methylcyclohex-3-en-1-yl)methyl]silane
CID 12563990

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane?
The IUPAC name of 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane (CID 56996028) is 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane is C[Si](C)(Cl)C1CC2=CCC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane?
The InChIKey is JOSYJXSUYXXHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15ClSi/c1-11(2,10)9-6-7-3-4-8(9)5-7/h3,8-9H,4-6H2,1-2H3.
What are the key properties of 2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane?
2-bicyclo[2.2.1]hept-4-enyl-chloro-dimethylsilane has a molecular weight of 186.76 g/mol, XLogP of 3.54, 1 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-4-enyl-chloro-dimethylsilane is sourced from PubChem (CID 56996028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).