dimethyl-bis(2-propan-2-ylphenoxy)silane

C20H28O2Si — CID 91731534

IUPACdimethyl-bis(2-propan-2-ylphenoxy)silane
SMILESCC(C)c1ccccc1O[Si](C)(C)Oc1ccccc1C(C)C
InChIInChI=1S/C20H28O2Si/c1-15(2)17-11-7-9-13-19(17)21-23(5,6)22-20-14-10-8-12-18(20)16(3)4/h7-16H,1-6H3
InChIKeyPEODXEKAIGIGDV-UHFFFAOYSA-N
MW328.53 g/mol
LogP6.09
Rot. Bonds6

About dimethyl-bis(2-propan-2-ylphenoxy)silane

dimethyl-bis(2-propan-2-ylphenoxy)silane (PubChem CID 91731534) has the molecular formula C20H28O2Si and a molecular weight of 328.53 g/mol. Its IUPAC name is dimethyl-bis(2-propan-2-ylphenoxy)silane.

Molecular Properties

Compound Namedimethyl-bis(2-propan-2-ylphenoxy)silane
PubChem CID91731534
Molecular FormulaC20H28O2Si
Molecular Weight328.53 g/mol
Exact Mass328.19
IUPAC Namedimethyl-bis(2-propan-2-ylphenoxy)silane
SMILESCC(C)c1ccccc1O[Si](C)(C)Oc1ccccc1C(C)C
InChIInChI=1S/C20H28O2Si/c1-15(2)17-11-7-9-13-19(17)21-23(5,6)22-20-14-10-8-12-18(20)16(3)4/h7-16H,1-6H3
InChIKeyPEODXEKAIGIGDV-UHFFFAOYSA-N
XLogP6.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.53
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(2-propan-2-ylphenoxy)silane?
The IUPAC name of dimethyl-bis(2-propan-2-ylphenoxy)silane (CID 91731534) is dimethyl-bis(2-propan-2-ylphenoxy)silane.
What is the SMILES notation for dimethyl-bis(2-propan-2-ylphenoxy)silane?
The canonical SMILES for dimethyl-bis(2-propan-2-ylphenoxy)silane is CC(C)c1ccccc1O[Si](C)(C)Oc1ccccc1C(C)C.
What is the InChIKey of dimethyl-bis(2-propan-2-ylphenoxy)silane?
The InChIKey is PEODXEKAIGIGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28O2Si/c1-15(2)17-11-7-9-13-19(17)21-23(5,6)22-20-14-10-8-12-18(20)16(3)4/h7-16H,1-6H3.
What are the key properties of dimethyl-bis(2-propan-2-ylphenoxy)silane?
dimethyl-bis(2-propan-2-ylphenoxy)silane has a molecular weight of 328.53 g/mol, XLogP of 6.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-propan-2-ylphenoxy)silane is sourced from PubChem (CID 91731534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).