diethoxymethyl(2-phenylethenyl)silane

C13H20O2Si — CID 71327103

IUPACdiethoxymethyl(2-phenylethenyl)silane
SMILESCCOC(OCC)[SiH2]C=Cc1ccccc1
InChIInChI=1S/C13H20O2Si/c1-3-14-13(15-4-2)16-11-10-12-8-6-5-7-9-12/h5-11,13H,3-4,16H2,1-2H3
InChIKeyGKJOAFQHSUBART-UHFFFAOYSA-N
MW236.39 g/mol
LogP2.18
Rot. Bonds7

About diethoxymethyl(2-phenylethenyl)silane

diethoxymethyl(2-phenylethenyl)silane (PubChem CID 71327103) has the molecular formula C13H20O2Si and a molecular weight of 236.39 g/mol. Its IUPAC name is diethoxymethyl(2-phenylethenyl)silane.

Molecular Properties

Compound Namediethoxymethyl(2-phenylethenyl)silane
PubChem CID71327103
Molecular FormulaC13H20O2Si
Molecular Weight236.39 g/mol
Exact Mass236.12
IUPAC Namediethoxymethyl(2-phenylethenyl)silane
SMILESCCOC(OCC)[SiH2]C=Cc1ccccc1
InChIInChI=1S/C13H20O2Si/c1-3-14-13(15-4-2)16-11-10-12-8-6-5-7-9-12/h5-11,13H,3-4,16H2,1-2H3
InChIKeyGKJOAFQHSUBART-UHFFFAOYSA-N
XLogP2.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.39
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

[(E)-5,5-diethoxypent-1-enyl]benzene
CID 21423476
ethoxymethyl(2-phenylethenyl)silane
CID 154140007
[(E,1R)-1-ethoxy-3-phenylprop-2-enyl]benzene
CID 100939369
2-phenylethenyl(propyl)silane
CID 123611778
1,1-diethoxyethane;(Z)-3-phenylprop-2-enal
CID 87487130
3-methoxypent-1-enylbenzene
CID 71364960
(E,3R)-6,6-diethoxy-1-phenylhex-1-en-4-yn-3-ol
CID 101388650
[(E)-1-ethoxy-3-phenylprop-2-enylidene]manganese
CID 11121228
5-ethoxypent-1-enylbenzene
CID 54285670
1-ethoxy-4-(2-phenylethenyl)benzene
CID 54277622
ethyl 2-hydroxy-6-phenylhex-5-enoate
CID 69249152
trimethyl(2-phenylethenylsilylmethoxy)silane
CID 161105391

Frequently Asked Questions

What is the IUPAC name of diethoxymethyl(2-phenylethenyl)silane?
The IUPAC name of diethoxymethyl(2-phenylethenyl)silane (CID 71327103) is diethoxymethyl(2-phenylethenyl)silane.
What is the SMILES notation for diethoxymethyl(2-phenylethenyl)silane?
The canonical SMILES for diethoxymethyl(2-phenylethenyl)silane is CCOC(OCC)[SiH2]C=Cc1ccccc1.
What is the InChIKey of diethoxymethyl(2-phenylethenyl)silane?
The InChIKey is GKJOAFQHSUBART-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2Si/c1-3-14-13(15-4-2)16-11-10-12-8-6-5-7-9-12/h5-11,13H,3-4,16H2,1-2H3.
What are the key properties of diethoxymethyl(2-phenylethenyl)silane?
diethoxymethyl(2-phenylethenyl)silane has a molecular weight of 236.39 g/mol, XLogP of 2.18, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxymethyl(2-phenylethenyl)silane is sourced from PubChem (CID 71327103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).