6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol

C17H28O2Si — CID 10493897

IUPAC6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol
SMILESCc1ccc(/C=C\CO[Si](C)(C)C(C)(C)C)c(O)c1C
InChIInChI=1S/C17H28O2Si/c1-13-10-11-15(16(18)14(13)2)9-8-12-19-20(6,7)17(3,4)5/h8-11,18H,12H2,1-7H3/b9-8-
InChIKeyHXTFJVQCJLTCDO-HJWRWDBZSA-N
MW292.50 g/mol
LogP5.04
Rot. Bonds4

About 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol

6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol (PubChem CID 10493897) has the molecular formula C17H28O2Si and a molecular weight of 292.50 g/mol. Its IUPAC name is 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol.

Molecular Properties

Compound Name6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol
PubChem CID10493897
Molecular FormulaC17H28O2Si
Molecular Weight292.50 g/mol
Exact Mass292.19
IUPAC Name6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol
SMILESCc1ccc(/C=C\CO[Si](C)(C)C(C)(C)C)c(O)c1C
InChIInChI=1S/C17H28O2Si/c1-13-10-11-15(16(18)14(13)2)9-8-12-19-20(6,7)17(3,4)5/h8-11,18H,12H2,1-7H3/b9-8-
InChIKeyHXTFJVQCJLTCDO-HJWRWDBZSA-N
XLogP5.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.50
LogP ≤ 55.04
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-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-3,5-dimethylphenol
CID 10493896
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexa-2,4-dienoxy]-dimethylsilane
CID 123215238
2-[2-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]phenyl]-1-(4-methylsulfanylphenyl)ethanone
CID 10501857
tert-butyl-[3-(3-chlorophenyl)prop-2-enoxy]-dimethylsilane
CID 67464197
tert-butyl-dimethyl-[(E)-3-(4-nitrophenyl)prop-2-enoxy]silane
CID 177135121
tert-butyl-dimethyl-[(Z)-pent-2-en-4-ynoxy]silane
CID 135083715
tert-butyl-(5,5-dimethylhex-2-enoxy)-dimethylsilane
CID 76815810
tert-butyl-[(Z)-5,5-dimethylhex-2-enoxy]-dimethylsilane
CID 58534802
4-[tert-butyl(dimethyl)silyl]oxybut-2-enoic acid
CID 85272131
(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enoic acid
CID 87108753
tert-butyl [(Z)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl] carbonate
CID 59981762
2-[(E)-4-[tert-butyl(dimethyl)silyl]oxybut-2-enyl]-2-[(E)-3-phenylprop-2-enyl]propane-1,3-diol
CID 16720182

Frequently Asked Questions

What is the IUPAC name of 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol?
The IUPAC name of 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol (CID 10493897) is 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol.
What is the SMILES notation for 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol?
The canonical SMILES for 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol is Cc1ccc(/C=C\CO[Si](C)(C)C(C)(C)C)c(O)c1C.
What is the InChIKey of 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol?
The InChIKey is HXTFJVQCJLTCDO-HJWRWDBZSA-N. The full InChI is InChI=1S/C17H28O2Si/c1-13-10-11-15(16(18)14(13)2)9-8-12-19-20(6,7)17(3,4)5/h8-11,18H,12H2,1-7H3/b9-8-.
What are the key properties of 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol?
6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol has a molecular weight of 292.50 g/mol, XLogP of 5.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(Z)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]-2,3-dimethylphenol is sourced from PubChem (CID 10493897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).