tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane

C21H28Si — CID 101151962

IUPACtert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)/C=C(/Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H28Si/c1-21(2,3)22(4,5)17-20(19-14-10-7-11-15-19)16-18-12-8-6-9-13-18/h6-15,17H,16H2,1-5H3/b20-17-
InChIKeyFDEJCNDKRWOESL-JZJYNLBNSA-N
MW308.54 g/mol
LogP6.36
Rot. Bonds4

About tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane

tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane (PubChem CID 101151962) has the molecular formula C21H28Si and a molecular weight of 308.54 g/mol. Its IUPAC name is tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane
PubChem CID101151962
Molecular FormulaC21H28Si
Molecular Weight308.54 g/mol
Exact Mass308.20
IUPAC Nametert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)/C=C(/Cc1ccccc1)c1ccccc1
InChIInChI=1S/C21H28Si/c1-21(2,3)22(4,5)17-20(19-14-10-7-11-15-19)16-18-12-8-6-9-13-18/h6-15,17H,16H2,1-5H3/b20-17-
InChIKeyFDEJCNDKRWOESL-JZJYNLBNSA-N
XLogP6.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.54
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

[(E)-1-phenylbut-2-en-2-yl]benzene
CID 6152777
(Z)-3-[tert-butyl(dimethyl)silyl]-2-phenylprop-2-enal
CID 11064715
trimethyl(3-phenylprop-1-en-2-yl)silane
CID 530293
tert-butyl-[(Z)-2-iodo-3-phenylprop-1-enyl]-diphenylsilane
CID 10096760
benzoic acid;tert-butyl-hydroxy-dimethylsilane
CID 71403721
[(Z)-5-bromo-1-phenylpent-2-en-2-yl]benzene
CID 19703232
(Z)-4-[ditert-butyl(hydroxy)silyl]-1,3-diphenylbut-3-en-2-amine
CID 102280219
[tert-butyl(dimethyl)silyl] 2-phenylacetate
CID 528591
[(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene
CID 134934904
trimethyl-[(E)-2-phenyl-3-trimethylsilylprop-1-enyl]silane
CID 10015597
N-[tert-butyl(dimethyl)silyl]-2-methyl-3-phenylprop-1-en-1-imine
CID 122229684
(E)-1-phenylbut-2-en-2-ol
CID 170790149

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane?
The IUPAC name of tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane (CID 101151962) is tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane is CC(C)(C)[Si](C)(C)/C=C(/Cc1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane?
The InChIKey is FDEJCNDKRWOESL-JZJYNLBNSA-N. The full InChI is InChI=1S/C21H28Si/c1-21(2,3)22(4,5)17-20(19-14-10-7-11-15-19)16-18-12-8-6-9-13-18/h6-15,17H,16H2,1-5H3/b20-17-.
What are the key properties of tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane?
tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane has a molecular weight of 308.54 g/mol, XLogP of 6.36, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(Z)-2,3-diphenylprop-1-enyl]-dimethylsilane is sourced from PubChem (CID 101151962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).