ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane

C14H20OSi — CID 122403652

IUPACethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane
SMILESCCO[Si](C)(C)/C=C/C=C/c1ccccc1
InChIInChI=1S/C14H20OSi/c1-4-15-16(2,3)13-9-8-12-14-10-6-5-7-11-14/h5-13H,4H2,1-3H3/b12-8+,13-9+
InChIKeyQFHPSPPCGRLAMY-QHKWOANTSA-N
MW232.40 g/mol
LogP4.04
Rot. Bonds5

About ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane

ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane (PubChem CID 122403652) has the molecular formula C14H20OSi and a molecular weight of 232.40 g/mol. Its IUPAC name is ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane.

Molecular Properties

Compound Nameethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane
PubChem CID122403652
Molecular FormulaC14H20OSi
Molecular Weight232.40 g/mol
Exact Mass232.13
IUPAC Nameethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane
SMILESCCO[Si](C)(C)/C=C/C=C/c1ccccc1
InChIInChI=1S/C14H20OSi/c1-4-15-16(2,3)13-9-8-12-14-10-6-5-7-11-14/h5-13H,4H2,1-3H3/b12-8+,13-9+
InChIKeyQFHPSPPCGRLAMY-QHKWOANTSA-N
XLogP4.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethyl-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane
CID 101476587
4-phenylbuta-1,3-dienylbenzene
CID 162273071
[(1Z,3Z)-4-phenylbuta-1,3-dienyl]benzene
CID 139179602
triethoxy-[2-[(E)-2-phenylethenyl]phenyl]silane
CID 122203429
[(1Z,3E,5Z,7E)-8-phenylocta-1,3,5,7-tetraenyl]benzene
CID 124922219
[(3Z)-octa-1,3-dienyl]benzene
CID 154692518
ethyl-dihydroxy-[(E)-2-phenylethenyl]silane
CID 10559740
4-phenylbuta-1,3-dienylbenzene;bis(tripropylphosphane)
CID 173264936
ethyl (4E)-5-phenylpenta-2,4-dienoate
CID 173106795
[(E)-2-phenylethenyl]-tripropoxysilane
CID 22325671
ethyl (NE)-N-[(2Z,4Z)-5-phenylpenta-2,4-dienylidene]carbamate
CID 177450107
triethoxy-[2-[4-(2-triethoxysilylethenyl)phenyl]ethenyl]silane
CID 68851094

Frequently Asked Questions

What is the IUPAC name of ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane?
The IUPAC name of ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane (CID 122403652) is ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane.
What is the SMILES notation for ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane?
The canonical SMILES for ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane is CCO[Si](C)(C)/C=C/C=C/c1ccccc1.
What is the InChIKey of ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane?
The InChIKey is QFHPSPPCGRLAMY-QHKWOANTSA-N. The full InChI is InChI=1S/C14H20OSi/c1-4-15-16(2,3)13-9-8-12-14-10-6-5-7-11-14/h5-13H,4H2,1-3H3/b12-8+,13-9+.
What are the key properties of ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane?
ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane has a molecular weight of 232.40 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-[(1E,3E)-4-phenylbuta-1,3-dienyl]silane is sourced from PubChem (CID 122403652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).