dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane

C21H28SiSn — CID 177410764

IUPACdimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane
SMILESC[Si](C)(/C=C(/C=C/c1ccccc1)[Sn](C)(C)C)c1ccccc1
InChIInChI=1S/C18H19Si.3CH3.Sn/c1-19(2,18-14-7-4-8-15-18)16-10-9-13-17-11-5-3-6-12-17;;;;/h3-9,11-16H,1-2H3;3*1H3;/b13-9+,16-10?;;;;
InChIKeyYEOHNTZTJBBHJT-NDSOGTPUSA-N
MW427.25 g/mol
LogP5.66
Rot. Bonds5

About dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane

dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane (PubChem CID 177410764) has the molecular formula C21H28SiSn and a molecular weight of 427.25 g/mol. Its IUPAC name is dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane.

Molecular Properties

Compound Namedimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane
PubChem CID177410764
Molecular FormulaC21H28SiSn
Molecular Weight427.25 g/mol
Exact Mass428.10
IUPAC Namedimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane
SMILESC[Si](C)(/C=C(/C=C/c1ccccc1)[Sn](C)(C)C)c1ccccc1
InChIInChI=1S/C18H19Si.3CH3.Sn/c1-19(2,18-14-7-4-8-15-18)16-10-9-13-17-11-5-3-6-12-17;;;;/h3-9,11-16H,1-2H3;3*1H3;/b13-9+,16-10?;;;;
InChIKeyYEOHNTZTJBBHJT-NDSOGTPUSA-N
XLogP5.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.25
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[4-[dimethyl-[(Z)-2-phenylethenyl]silyl]phenyl]-dimethyl-[(Z)-2-phenylethenyl]silane
CID 101344758
[(Z)-2-[3-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethenyl]-dimethyl-phenylsilane
CID 11718251
(E)-3-[dimethyl(phenyl)silyl]prop-2-enoic acid
CID 10104447
dimethyl-phenyl-[(E)-3-phenylprop-2-enyl]silane
CID 11658889
dimethyl-phenyl-[(Z)-3-phenylprop-2-enyl]silane
CID 102586986
1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone
CID 11652058
[(1Z,3Z)-3-bromopenta-1,3-dienyl]benzene
CID 143617374
[(1E,3E)-2-ethyl-4-phenylbuta-1,3-dienyl]-trimethylsilane
CID 10036853
1,4-diphenylbuta-1,3-dien-2-yl(trimethyl)silane
CID 86083751
[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane
CID 101465859
trimethylsilyl (E)-3-phenylprop-2-eneperoxoate
CID 22561457
[(Z)-2-[dimethyl(phenyl)silyl]-1-phenylethenyl]-dimethyl-phenylsilane
CID 101395008

Frequently Asked Questions

What is the IUPAC name of dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane?
The IUPAC name of dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane (CID 177410764) is dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane.
What is the SMILES notation for dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane?
The canonical SMILES for dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane is C[Si](C)(/C=C(/C=C/c1ccccc1)[Sn](C)(C)C)c1ccccc1.
What is the InChIKey of dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane?
The InChIKey is YEOHNTZTJBBHJT-NDSOGTPUSA-N. The full InChI is InChI=1S/C18H19Si.3CH3.Sn/c1-19(2,18-14-7-4-8-15-18)16-10-9-13-17-11-5-3-6-12-17;;;;/h3-9,11-16H,1-2H3;3*1H3;/b13-9+,16-10?;;;;.
What are the key properties of dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane?
dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane has a molecular weight of 427.25 g/mol, XLogP of 5.66, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-phenyl-[(1Z,3E)-4-phenyl-2-trimethylstannylbuta-1,3-dienyl]silane is sourced from PubChem (CID 177410764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).