(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane

C11H15NO2Si — CID 139777207

IUPAC(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane
SMILESCC(C)(C)C(ON=[Si]=O)c1ccccc1
InChIInChI=1S/C11H15NO2Si/c1-11(2,3)10(14-12-15-13)9-7-5-4-6-8-9/h4-8,10H,1-3H3
InChIKeyMILNEBDERSWTDC-UHFFFAOYSA-N
MW221.33 g/mol
LogP2.94
Rot. Bonds3

About (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane

(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane (PubChem CID 139777207) has the molecular formula C11H15NO2Si and a molecular weight of 221.33 g/mol. Its IUPAC name is (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane.

Molecular Properties

Compound Name(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane
PubChem CID139777207
Molecular FormulaC11H15NO2Si
Molecular Weight221.33 g/mol
Exact Mass221.09
IUPAC Name(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane
SMILESCC(C)(C)C(ON=[Si]=O)c1ccccc1
InChIInChI=1S/C11H15NO2Si/c1-11(2,3)10(14-12-15-13)9-7-5-4-6-8-9/h4-8,10H,1-3H3
InChIKeyMILNEBDERSWTDC-UHFFFAOYSA-N
XLogP2.94
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

bis(2,2-dimethyl-1-phenylpropyl) carbonate
CID 139502993
[(1R)-2,2-dimethyl-1-phenylpropoxy]-trimethylsilane
CID 101471174
tetrakis((2,2-dimethyl-1-phenylpropoxy)-dihydroxyphosphanium);nickel
CID 88804753
4-methoxy-3,3-dimethyl-4-phenylbutan-2-one
CID 10420523
3-methoxy-2,2-dimethyl-1,3-diphenylpropan-1-one
CID 100923277
[(1R,3R)-3-hydroxy-2,2-dimethyl-1,3-diphenylpropyl] benzoate
CID 15182984
1-phenylethyl nitrite
CID 18989891
(2,2,2-trifluoro-1-methoxyethyl)benzene
CID 15275027
methyl (2R)-2-[(R)-methoxy(phenyl)methyl]-3,3-dimethylbutanoate
CID 10658335
methyl (2S)-2-[(R)-methoxy(phenyl)methyl]-3,3-dimethylbutanoate
CID 10538647
(3S)-3-methoxy-2,2-dimethyl-3-phenylpropan-1-ol
CID 14871890
2,2-dichloro-3-methoxy-1,3-diphenylpropan-1-one
CID 13184442

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane?
The IUPAC name of (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane (CID 139777207) is (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane.
What is the SMILES notation for (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane?
The canonical SMILES for (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane is CC(C)(C)C(ON=[Si]=O)c1ccccc1.
What is the InChIKey of (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane?
The InChIKey is MILNEBDERSWTDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2Si/c1-11(2,3)10(14-12-15-13)9-7-5-4-6-8-9/h4-8,10H,1-3H3.
What are the key properties of (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane?
(2,2-dimethyl-1-phenylpropoxy)imino-oxosilane has a molecular weight of 221.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethyl-1-phenylpropoxy)imino-oxosilane is sourced from PubChem (CID 139777207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).