dimethyl-(3-methylphenoxy)-propan-2-ylsilane

C12H20OSi — CID 532643

IUPACdimethyl-(3-methylphenoxy)-propan-2-ylsilane
SMILESCc1cccc(O[Si](C)(C)C(C)C)c1
InChIInChI=1S/C12H20OSi/c1-10(2)14(4,5)13-12-8-6-7-11(3)9-12/h6-10H,1-5H3
InChIKeyJZWHWSLBJKOEBI-UHFFFAOYSA-N
MW208.38 g/mol
LogP3.99
Rot. Bonds3

About dimethyl-(3-methylphenoxy)-propan-2-ylsilane

dimethyl-(3-methylphenoxy)-propan-2-ylsilane (PubChem CID 532643) has the molecular formula C12H20OSi and a molecular weight of 208.38 g/mol. Its IUPAC name is dimethyl-(3-methylphenoxy)-propan-2-ylsilane.

Molecular Properties

Compound Namedimethyl-(3-methylphenoxy)-propan-2-ylsilane
PubChem CID532643
Molecular FormulaC12H20OSi
Molecular Weight208.38 g/mol
Exact Mass208.13
IUPAC Namedimethyl-(3-methylphenoxy)-propan-2-ylsilane
SMILESCc1cccc(O[Si](C)(C)C(C)C)c1
InChIInChI=1S/C12H20OSi/c1-10(2)14(4,5)13-12-8-6-7-11(3)9-12/h6-10H,1-5H3
InChIKeyJZWHWSLBJKOEBI-UHFFFAOYSA-N
XLogP3.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(3-methylphenoxy)-propan-2-ylsilane?
The IUPAC name of dimethyl-(3-methylphenoxy)-propan-2-ylsilane (CID 532643) is dimethyl-(3-methylphenoxy)-propan-2-ylsilane.
What is the SMILES notation for dimethyl-(3-methylphenoxy)-propan-2-ylsilane?
The canonical SMILES for dimethyl-(3-methylphenoxy)-propan-2-ylsilane is Cc1cccc(O[Si](C)(C)C(C)C)c1.
What is the InChIKey of dimethyl-(3-methylphenoxy)-propan-2-ylsilane?
The InChIKey is JZWHWSLBJKOEBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSi/c1-10(2)14(4,5)13-12-8-6-7-11(3)9-12/h6-10H,1-5H3.
What are the key properties of dimethyl-(3-methylphenoxy)-propan-2-ylsilane?
dimethyl-(3-methylphenoxy)-propan-2-ylsilane has a molecular weight of 208.38 g/mol, XLogP of 3.99, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(3-methylphenoxy)-propan-2-ylsilane is sourced from PubChem (CID 532643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).