[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane

C12H18Cl2OSi — CID 70809258

IUPAC[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane
SMILESCC(C)(Cc1ccc(Cl)cc1Cl)[Si](C)(C)O
InChIInChI=1S/C12H18Cl2OSi/c1-12(2,16(3,4)15)8-9-5-6-10(13)7-11(9)14/h5-7,15H,8H2,1-4H3
InChIKeyFMJWIEIMGLACML-UHFFFAOYSA-N
MW277.27 g/mol
LogP4.51
Rot. Bonds3

About [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane

[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane (PubChem CID 70809258) has the molecular formula C12H18Cl2OSi and a molecular weight of 277.27 g/mol. Its IUPAC name is [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane.

Molecular Properties

Compound Name[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane
PubChem CID70809258
Molecular FormulaC12H18Cl2OSi
Molecular Weight277.27 g/mol
Exact Mass276.05
IUPAC Name[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane
SMILESCC(C)(Cc1ccc(Cl)cc1Cl)[Si](C)(C)O
InChIInChI=1S/C12H18Cl2OSi/c1-12(2,16(3,4)15)8-9-5-6-10(13)7-11(9)14/h5-7,15H,8H2,1-4H3
InChIKeyFMJWIEIMGLACML-UHFFFAOYSA-N
XLogP4.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(2,4-dichlorophenyl)methoxy]-dimethylsilane
CID 91737025
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CID 159514027
1-(2,4-dichlorophenyl)-3-(ethylamino)-2-methylpropan-2-ol
CID 66039611
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1-(2,4-dichlorophenyl)-2-(2,5-dimethylphenyl)propan-2-ol
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1-[2,2-bis(chloromethyl)butyl]-2,4-dichlorobenzene
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1,1-dibromo-2-(2,4-dichlorophenyl)ethanesulfinic acid
CID 66789276
1-(2,4-dichlorophenyl)-2-thiophen-2-ylpropan-2-ol
CID 65145566
2,4-dichloro-1-[1,1-dichloro-2-(2,4-dichlorophenyl)ethyl]benzene
CID 122575608
2,4-dichloro-1-[2,2-dibromo-2-[1,1-dibromo-2-(2,4-dichlorophenyl)ethyl]sulfonylethyl]benzene
CID 87151632
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CID 114833275

Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane?
The IUPAC name of [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane (CID 70809258) is [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane.
What is the SMILES notation for [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane?
The canonical SMILES for [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane is CC(C)(Cc1ccc(Cl)cc1Cl)[Si](C)(C)O.
What is the InChIKey of [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane?
The InChIKey is FMJWIEIMGLACML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18Cl2OSi/c1-12(2,16(3,4)15)8-9-5-6-10(13)7-11(9)14/h5-7,15H,8H2,1-4H3.
What are the key properties of [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane?
[1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane has a molecular weight of 277.27 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dichlorophenyl)-2-methylpropan-2-yl]-hydroxy-dimethylsilane is sourced from PubChem (CID 70809258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).