CID 22325800

C13H27O3Si4 — CID 22325800

IUPAC—
SMILESC[Si](C)O[Si](O[Si](C)C)(O[Si](C)C)C12C=CC(CC1)C2
InChIInChI=1S/C13H27O3Si4/c1-17(2)14-20(15-18(3)4,16-19(5)6)13-9-7-12(11-13)8-10-13/h7,9,12H,8,10-11H2,1-6H3
InChIKeyYWDYFOANNJSGPT-UHFFFAOYSA-N
MW343.70 g/mol
LogP3.84
Rot. Bonds7

About CID 22325800

CID 22325800 (PubChem CID 22325800) has the molecular formula C13H27O3Si4 and a molecular weight of 343.70 g/mol.

Molecular Properties

Compound NameCID 22325800
PubChem CID22325800
Molecular FormulaC13H27O3Si4
Molecular Weight343.70 g/mol
Exact Mass343.10
IUPAC Name—
SMILESC[Si](C)O[Si](O[Si](C)C)(O[Si](C)C)C12C=CC(CC1)C2
InChIInChI=1S/C13H27O3Si4/c1-17(2)14-20(15-18(3)4,16-19(5)6)13-9-7-12(11-13)8-10-13/h7,9,12H,8,10-11H2,1-6H3
InChIKeyYWDYFOANNJSGPT-UHFFFAOYSA-N
XLogP3.84
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.70
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

1-bicyclo[2.2.1]hept-2-enyl(trimethyl)silane
CID 66700380
1-bicyclo[2.2.1]hept-2-enyl-tris[[ethenyl(dimethyl)silyl]oxy]silane
CID 22325685
1-bicyclo[2.2.1]hept-2-enyl-hydroxy-bis(trimethylsilyloxy)silane
CID 22325811
1-bicyclo[2.2.1]hept-2-enyl-dimethoxy-(2-methylpropyl)silane
CID 141477581
bis(1-bicyclo[2.2.1]hept-2-enyl-methyl-propylsilyl)-[bis(1-bicyclo[2.2.1]hept-2-enyl-methyl-propylsilyl)-cyclohexylsilyl]oxy-cyclohexylsilane
CID 87986335
1-bicyclo[2.2.1]hept-2-enylmethoxy-ethyl-dimethoxysilane
CID 141272165
bicyclo[2.2.1]hept-2-ene-1-carbonitrile
CID 19737575
1-(2-methylcyclopentyl)bicyclo[2.2.1]hept-2-ene
CID 21426215
2-(1-bicyclo[2.2.1]hept-2-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 141481605
bicyclo[2.2.1]hept-2-ene-1-carboxylic acid;trimethylsilane
CID 173193263
1-(2,3,3,4,4,5,5,5-octafluoropentan-2-yl)bicyclo[2.2.1]hept-2-ene
CID 175913012
1-(1-bicyclo[2.2.1]hept-2-enyl)-1,3,5,2,4,6-triazatriphosphinane
CID 173269047

Frequently Asked Questions

What is the IUPAC name of CID 22325800?
The IUPAC name of CID 22325800 (CID 22325800) is not available.
What is the SMILES notation for CID 22325800?
The canonical SMILES for CID 22325800 is C[Si](C)O[Si](O[Si](C)C)(O[Si](C)C)C12C=CC(CC1)C2.
What is the InChIKey of CID 22325800?
The InChIKey is YWDYFOANNJSGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27O3Si4/c1-17(2)14-20(15-18(3)4,16-19(5)6)13-9-7-12(11-13)8-10-13/h7,9,12H,8,10-11H2,1-6H3.
What are the key properties of CID 22325800?
CID 22325800 has a molecular weight of 343.70 g/mol, XLogP of 3.84, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22325800 is sourced from PubChem (CID 22325800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).