trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane

C16H26O2Si — CID 71271588

IUPACtrimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane
SMILESCC(C)(C)O/C(=C\Cc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C16H26O2Si/c1-16(2,3)17-15(18-19(4,5)6)13-12-14-10-8-7-9-11-14/h7-11,13H,12H2,1-6H3/b15-13+
InChIKeySSYLRDWECYQGST-FYWRMAATSA-N
MW278.47 g/mol
LogP4.74
Rot. Bonds5

About trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane

trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane (PubChem CID 71271588) has the molecular formula C16H26O2Si and a molecular weight of 278.47 g/mol. Its IUPAC name is trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane
PubChem CID71271588
Molecular FormulaC16H26O2Si
Molecular Weight278.47 g/mol
Exact Mass278.17
IUPAC Nametrimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane
SMILESCC(C)(C)O/C(=C\Cc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C16H26O2Si/c1-16(2,3)17-15(18-19(4,5)6)13-12-14-10-8-7-9-11-14/h7-11,13H,12H2,1-6H3/b15-13+
InChIKeySSYLRDWECYQGST-FYWRMAATSA-N
XLogP4.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(E)-N,N-dibenzyl-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenamine
CID 13483445
tert-butyl (E)-2-hydroxy-4-phenylbut-2-enoate
CID 70989975
tert-butyl (E)-2-methyl-4-phenylbut-2-enoate
CID 10857330
N-[(E)-2-[(2-methylpropan-2-yl)oxy]-2-trimethylsilyloxyethenyl]-1,1-diphenylmethanimine
CID 11824747
trimethyl-[(2E,4Z)-1,1,1-trifluoro-6-phenyl-4-trimethylsilyloxyhexa-2,4-dien-2-yl]oxysilane
CID 177391977
tert-butyl 4-phenyl-2-propan-2-ylbut-2-enoate
CID 54019128
trimethyl-[(Z)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
CID 10878232
3,3-diethoxyprop-2-enylbenzene
CID 68782187
triphenyl-[(Z)-4-phenylbut-2-en-2-yl]oxysilane
CID 101425357
ditert-butyl (2E)-2-(2-phenylethylidene)pentanedioate
CID 10936923
tert-butyl N-[(E)-1-hydroxy-4-phenylbut-2-en-2-yl]carbamate
CID 100950560
trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]dodeca-1,11-dienoxy]silane
CID 101443254

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane?
The IUPAC name of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane (CID 71271588) is trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane.
What is the SMILES notation for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane?
The canonical SMILES for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane is CC(C)(C)O/C(=C\Cc1ccccc1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane?
The InChIKey is SSYLRDWECYQGST-FYWRMAATSA-N. The full InChI is InChI=1S/C16H26O2Si/c1-16(2,3)17-15(18-19(4,5)6)13-12-14-10-8-7-9-11-14/h7-11,13H,12H2,1-6H3/b15-13+.
What are the key properties of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane?
trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane has a molecular weight of 278.47 g/mol, XLogP of 4.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-enoxy]silane is sourced from PubChem (CID 71271588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).