dimethyl-bis(1-phenylpropoxy)silane

C20H28O2Si — CID 91741555

IUPACdimethyl-bis(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H28O2Si/c1-5-19(17-13-9-7-10-14-17)21-23(3,4)22-20(6-2)18-15-11-8-12-16-18/h7-16,19-20H,5-6H2,1-4H3
InChIKeyLNLATZDXFSTVRG-UHFFFAOYSA-N
MW328.53 g/mol
LogP6.02
Rot. Bonds8

About dimethyl-bis(1-phenylpropoxy)silane

dimethyl-bis(1-phenylpropoxy)silane (PubChem CID 91741555) has the molecular formula C20H28O2Si and a molecular weight of 328.53 g/mol. Its IUPAC name is dimethyl-bis(1-phenylpropoxy)silane.

Molecular Properties

Compound Namedimethyl-bis(1-phenylpropoxy)silane
PubChem CID91741555
Molecular FormulaC20H28O2Si
Molecular Weight328.53 g/mol
Exact Mass328.19
IUPAC Namedimethyl-bis(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H28O2Si/c1-5-19(17-13-9-7-10-14-17)21-23(3,4)22-20(6-2)18-15-11-8-12-16-18/h7-16,19-20H,5-6H2,1-4H3
InChIKeyLNLATZDXFSTVRG-UHFFFAOYSA-N
XLogP6.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.53
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dimethyl-(2,3,4,5,6-pentafluorophenyl)-(1-phenylpropoxy)silane
CID 91742948
butoxy-diethyl-(1-phenylpropoxy)silane
CID 91739737
diethyl-(1-phenylpropoxy)-undecoxysilane
CID 91743912
1-(trifluoromethoxy)propylbenzene
CID 174717015
1-(1-phenylpropoxy)ethanethiol
CID 126486623
4,4,5,5-tetramethyl-2-(1-phenylpropoxy)-1,3,2-dioxaborolane
CID 132609190
1-pentoxypropylbenzene
CID 57033372
1-phosphanylsulfonyloxypropylbenzene
CID 174794553
1-(1-phenylpropoxy)ethane-1,2-diol
CID 68934607
1-phenylpropyl 2-hydroxyacetate
CID 174847309
1-phenylpropyl 2-phenylpropanoate
CID 174489936
3-(1-phenylpropoxy)propane-1,2-diol
CID 134964704

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(1-phenylpropoxy)silane?
The IUPAC name of dimethyl-bis(1-phenylpropoxy)silane (CID 91741555) is dimethyl-bis(1-phenylpropoxy)silane.
What is the SMILES notation for dimethyl-bis(1-phenylpropoxy)silane?
The canonical SMILES for dimethyl-bis(1-phenylpropoxy)silane is CCC(O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1.
What is the InChIKey of dimethyl-bis(1-phenylpropoxy)silane?
The InChIKey is LNLATZDXFSTVRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28O2Si/c1-5-19(17-13-9-7-10-14-17)21-23(3,4)22-20(6-2)18-15-11-8-12-16-18/h7-16,19-20H,5-6H2,1-4H3.
What are the key properties of dimethyl-bis(1-phenylpropoxy)silane?
dimethyl-bis(1-phenylpropoxy)silane has a molecular weight of 328.53 g/mol, XLogP of 6.02, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(1-phenylpropoxy)silane is sourced from PubChem (CID 91741555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).