tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane

C17H28OSi — CID 142662334

IUPACtert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccccc1CC1CC1
InChIInChI=1S/C17H28OSi/c1-17(2,3)19(4,5)18-13-16-9-7-6-8-15(16)12-14-10-11-14/h6-9,14H,10-13H2,1-5H3
InChIKeyXYHPGUZRNBVJSK-UHFFFAOYSA-N
MW276.50 g/mol
LogP5.16
Rot. Bonds5

About tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane

tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane (PubChem CID 142662334) has the molecular formula C17H28OSi and a molecular weight of 276.50 g/mol. Its IUPAC name is tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane
PubChem CID142662334
Molecular FormulaC17H28OSi
Molecular Weight276.50 g/mol
Exact Mass276.19
IUPAC Nametert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccccc1CC1CC1
InChIInChI=1S/C17H28OSi/c1-17(2,3)19(4,5)18-13-16-9-7-6-8-15(16)12-14-10-11-14/h6-9,14H,10-13H2,1-5H3
InChIKeyXYHPGUZRNBVJSK-UHFFFAOYSA-N
XLogP5.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.50
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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
ditert-butyl [2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methyl phosphate
CID 168825886
5-[[tert-butyl(dimethyl)silyl]oxymethyl]naphthalen-2-amine
CID 91436936
tert-butyl-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexyl]methoxy]-diphenylsilane
CID 102242282
tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]thiophen-3-yl]methoxy]-dimethylsilane
CID 10690703
1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-ol
CID 19981621
(E)-1-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]-N-(trimethylsilylmethyl)methanimine
CID 14687071
4-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-iodoaniline
CID 125465241
tert-butyl-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-phenylmethoxyphenyl]methoxy]-dimethylsilane
CID 57099550
2-[2-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethynyl]benzaldehyde
CID 11100219
tert-butyl-[(2-chloroquinolin-3-yl)methoxy]-dimethylsilane
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tert-butyl-[[2-[(E)-hept-1-enyl]phenyl]methoxy]-dimethylsilane
CID 22559339

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane (CID 142662334) is tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1ccccc1CC1CC1.
What is the InChIKey of tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane?
The InChIKey is XYHPGUZRNBVJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28OSi/c1-17(2,3)19(4,5)18-13-16-9-7-6-8-15(16)12-14-10-11-14/h6-9,14H,10-13H2,1-5H3.
What are the key properties of tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane?
tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane has a molecular weight of 276.50 g/mol, XLogP of 5.16, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[2-(cyclopropylmethyl)phenyl]methoxy]-dimethylsilane is sourced from PubChem (CID 142662334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).