1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol

C16H28O2Si — CID 19981621

IUPAC1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol
SMILESCCC(O)c1ccccc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H28O2Si/c1-7-15(17)14-11-9-8-10-13(14)12-18-19(5,6)16(2,3)4/h8-11,15,17H,7,12H2,1-6H3
InChIKeyFQJQGHMAFALUAA-UHFFFAOYSA-N
MW280.48 g/mol
LogP4.65
Rot. Bonds5

About 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol

1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol (PubChem CID 19981621) has the molecular formula C16H28O2Si and a molecular weight of 280.48 g/mol. Its IUPAC name is 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol.

Molecular Properties

Compound Name1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol
PubChem CID19981621
Molecular FormulaC16H28O2Si
Molecular Weight280.48 g/mol
Exact Mass280.19
IUPAC Name1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol
SMILESCCC(O)c1ccccc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H28O2Si/c1-7-15(17)14-11-9-8-10-13(14)12-18-19(5,6)16(2,3)4/h8-11,15,17H,7,12H2,1-6H3
InChIKeyFQJQGHMAFALUAA-UHFFFAOYSA-N
XLogP4.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanol
CID 102186248
(1S)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[(S)-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]-hydroxymethyl]-2,2,4-trimethylcyclohex-3-en-1-ol
CID 10875161
tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane
CID 142662334
(E)-1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]-N-(trimethylsilylmethyl)methanimine
CID 14687071
[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol
CID 102217007
4-(2-amino-1-hydroxyethyl)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenol
CID 66988165
tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]thiophen-3-yl]methoxy]-dimethylsilane
CID 10690703
ditert-butyl [2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methyl phosphate
CID 168825886
2-bromo-1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-phenylmethoxyphenyl]ethanol
CID 76807098
tert-butyl-[[2-[(E)-hept-1-enyl]phenyl]methoxy]-dimethylsilane
CID 22559339
methyl (2S)-2-[[1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]anilino]-1-oxobutan-2-yl]amino]-2-phenylacetate
CID 11259968
(1S)-1-(2-tert-butylsulfanylphenyl)propan-1-ol
CID 103960688

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol?
The IUPAC name of 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol (CID 19981621) is 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol.
What is the SMILES notation for 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol?
The canonical SMILES for 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol is CCC(O)c1ccccc1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol?
The InChIKey is FQJQGHMAFALUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O2Si/c1-7-15(17)14-11-9-8-10-13(14)12-18-19(5,6)16(2,3)4/h8-11,15,17H,7,12H2,1-6H3.
What are the key properties of 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol?
1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol has a molecular weight of 280.48 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol is sourced from PubChem (CID 19981621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).