dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane

C21H26Si — CID 102173313

IUPACdimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane
SMILESCC(C)=C=C(CCc1ccccc1)[Si](C)(C)c1ccccc1
InChIInChI=1S/C21H26Si/c1-18(2)17-21(16-15-19-11-7-5-8-12-19)22(3,4)20-13-9-6-10-14-20/h5-14H,15-16H2,1-4H3
InChIKeyVVTQGYWONMYLFE-UHFFFAOYSA-N
MW306.53 g/mol
LogP5.27
Rot. Bonds5

About dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane

dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane (PubChem CID 102173313) has the molecular formula C21H26Si and a molecular weight of 306.53 g/mol. Its IUPAC name is dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane.

Molecular Properties

Compound Namedimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane
PubChem CID102173313
Molecular FormulaC21H26Si
Molecular Weight306.53 g/mol
Exact Mass306.18
IUPAC Namedimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane
SMILESCC(C)=C=C(CCc1ccccc1)[Si](C)(C)c1ccccc1
InChIInChI=1S/C21H26Si/c1-18(2)17-21(16-15-19-11-7-5-8-12-19)22(3,4)20-13-9-6-10-14-20/h5-14H,15-16H2,1-4H3
InChIKeyVVTQGYWONMYLFE-UHFFFAOYSA-N
XLogP5.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.53
LogP ≤ 55.27
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

7-[dimethyl(phenyl)silyl]-9-phenylnona-5,6-dien-1-ol
CID 44604092
1-[dimethyl(phenyl)silyl]-4-phenylbutan-1-one
CID 10612922
hexa-1,2-dien-3-yl-dimethyl-phenylsilane
CID 11736076
dimethyl-phenyl-(6-phenyl-1-trimethylsilylhexa-1,2-dienyl)silane
CID 11451382
[(E)-1-iodo-5-phenylpent-1-enyl]-dimethyl-phenylsilane
CID 11338697
4-[dimethyl(phenyl)silyl]-2-phenylpenta-2,3-dien-1-ol
CID 164685527
trimethyl-[5-phenyl-3-(2-phenylethyl)pent-2-enyl]silane
CID 10958257
(3Z)-3-(1-hydroxyethylidene)-4-methylidene-7-phenylheptane-2,5-dione
CID 11623032
(3-ethyl-5-phenylpenta-1,2-dienyl)-trimethylsilane
CID 51349622
(3-methyl-6-phenylhex-3-enyl)benzene
CID 175487597
phenol;4-phenylbutan-2-one
CID 160537429
1-[dimethyl(phenyl)silyl]butan-1-one
CID 10822186

Frequently Asked Questions

What is the IUPAC name of dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane?
The IUPAC name of dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane (CID 102173313) is dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane.
What is the SMILES notation for dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane?
The canonical SMILES for dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane is CC(C)=C=C(CCc1ccccc1)[Si](C)(C)c1ccccc1.
What is the InChIKey of dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane?
The InChIKey is VVTQGYWONMYLFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26Si/c1-18(2)17-21(16-15-19-11-7-5-8-12-19)22(3,4)20-13-9-6-10-14-20/h5-14H,15-16H2,1-4H3.
What are the key properties of dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane?
dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane has a molecular weight of 306.53 g/mol, XLogP of 5.27, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(5-methyl-1-phenylhexa-3,4-dien-3-yl)-phenylsilane is sourced from PubChem (CID 102173313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).