dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane

C17H30O2Si2 — CID 173451898

IUPACdimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane
SMILESCc1ccc(CC[SiH](C)OC2([SiH](C)C)CCCCO2)cc1
InChIInChI=1S/C17H30O2Si2/c1-15-7-9-16(10-8-15)11-14-21(4)19-17(20(2)3)12-5-6-13-18-17/h7-10,20-21H,5-6,11-14H2,1-4H3
InChIKeyMLZCTHVIEMILGG-UHFFFAOYSA-N
MW322.60 g/mol
LogP3.83
Rot. Bonds6

About dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane

dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane (PubChem CID 173451898) has the molecular formula C17H30O2Si2 and a molecular weight of 322.60 g/mol. Its IUPAC name is dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane.

Molecular Properties

Compound Namedimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane
PubChem CID173451898
Molecular FormulaC17H30O2Si2
Molecular Weight322.60 g/mol
Exact Mass322.18
IUPAC Namedimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane
SMILESCc1ccc(CC[SiH](C)OC2([SiH](C)C)CCCCO2)cc1
InChIInChI=1S/C17H30O2Si2/c1-15-7-9-16(10-8-15)11-14-21(4)19-17(20(2)3)12-5-6-13-18-17/h7-10,20-21H,5-6,11-14H2,1-4H3
InChIKeyMLZCTHVIEMILGG-UHFFFAOYSA-N
XLogP3.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.60
LogP ≤ 53.83
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-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane?
The IUPAC name of dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane (CID 173451898) is dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane.
What is the SMILES notation for dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane?
The canonical SMILES for dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane is Cc1ccc(CC[SiH](C)OC2([SiH](C)C)CCCCO2)cc1.
What is the InChIKey of dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane?
The InChIKey is MLZCTHVIEMILGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2Si2/c1-15-7-9-16(10-8-15)11-14-21(4)19-17(20(2)3)12-5-6-13-18-17/h7-10,20-21H,5-6,11-14H2,1-4H3.
What are the key properties of dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane?
dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane has a molecular weight of 322.60 g/mol, XLogP of 3.83, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[2-[methyl-[2-(4-methylphenyl)ethyl]silyl]oxyoxan-2-yl]silane is sourced from PubChem (CID 173451898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).