6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol

C15H32O2Si — CID 57193279

IUPAC6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol
SMILESC=CCC(CO)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O2Si/c1-7-10-14(13-16)11-8-9-12-17-18(5,6)15(2,3)4/h7,14,16H,1,8-13H2,2-6H3
InChIKeyOUCAMLGRARMPSI-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.36
Rot. Bonds9

About 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol

6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol (PubChem CID 57193279) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol.

Molecular Properties

Compound Name6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol
PubChem CID57193279
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol
SMILESC=CCC(CO)CCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O2Si/c1-7-10-14(13-16)11-8-9-12-17-18(5,6)15(2,3)4/h7,14,16H,1,8-13H2,2-6H3
InChIKeyOUCAMLGRARMPSI-UHFFFAOYSA-N
XLogP4.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3S,4S,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-1-en-4-ol
CID 13523927
(3S,4R,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-1-en-4-ol
CID 134993137
(3R,4S,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-1-en-4-ol
CID 134993187
(3R,4R,5R,6S)-6-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-1-en-4-ol
CID 13523928
(2R,3S,4S)-2-[tert-butyl(dimethyl)silyl]oxy-4-ethenyloctan-3-ol
CID 14107959
(3S,4S,7S)-9-[tert-butyl(dimethyl)silyl]oxy-3,7-dimethylnon-1-en-4-ol
CID 24767663
(3R,7R)-3-methyl-7-triethylsilyloxydec-1-en-5-ol
CID 53328468
(3R,4R)-7-[tert-butyl(dimethyl)silyl]oxy-3-methylhept-1-en-4-ol
CID 71503861
2-(6-Trimethylsilylcyclohex-2-en-1-yl)ethanol
CID 73116563
(2S,3S,4R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-6-en-2-ol
CID 134854744
(2S,4R,5R)-5-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylhept-6-en-1-ol
CID 134856951
(3S,4S,5R,6R)-6-[tert-butyl(dimethyl)silyl]oxy-3,5-dimethylhept-1-en-4-ol
CID 134930487

Frequently Asked Questions

What is the IUPAC name of 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol?
The IUPAC name of 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol (CID 57193279) is 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol.
What is the SMILES notation for 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol?
The canonical SMILES for 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol is C=CCC(CO)CCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol?
The InChIKey is OUCAMLGRARMPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-7-10-14(13-16)11-8-9-12-17-18(5,6)15(2,3)4/h7,14,16H,1,8-13H2,2-6H3.
What are the key properties of 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol?
6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol has a molecular weight of 272.50 g/mol, XLogP of 4.36, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhexan-1-ol is sourced from PubChem (CID 57193279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).