(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol

C15H30O2Si — CID 10061716

IUPAC(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol
SMILESC/C(=C\C/C=C/CCO[Si](C)(C)C(C)(C)C)CO
InChIInChI=1S/C15H30O2Si/c1-14(13-16)11-9-7-8-10-12-17-18(5,6)15(2,3)4/h7-8,11,16H,9-10,12-13H2,1-6H3/b8-7+,14-11+
InChIKeyXMHFSTLQQJSTMP-DQBULIGTSA-N
MW270.49 g/mol
LogP4.28
Rot. Bonds7

About (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol

(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol (PubChem CID 10061716) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol.

Molecular Properties

Compound Name(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol
PubChem CID10061716
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Name(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol
SMILESC/C(=C\C/C=C/CCO[Si](C)(C)C(C)(C)C)CO
InChIInChI=1S/C15H30O2Si/c1-14(13-16)11-9-7-8-10-12-17-18(5,6)15(2,3)4/h7-8,11,16H,9-10,12-13H2,1-6H3/b8-7+,14-11+
InChIKeyXMHFSTLQQJSTMP-DQBULIGTSA-N
XLogP4.28
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.28
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

7-[tert-butyl(dimethyl)silyl]oxy-2-methylhept-2-en-1-ol
CID 74029317
tert-butyl-[(E)-4-fluoropent-3-enoxy]-dimethylsilane
CID 59072765
tert-butyl-[(Z)-4-[tert-butyl(dimethyl)silyl]but-3-enoxy]-dimethylsilane
CID 11702169
(E)-5-[tert-butyl(dimethyl)silyl]oxypent-2-enoic acid
CID 87677044
5-[tert-butyl(dimethyl)silyl]oxypent-2-enamide
CID 72594662
4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
CID 71340946
methyl (E)-5-[tert-butyl(dimethyl)silyl]oxy-2-methylpent-2-enoate
CID 11379901
(3E,5E)-9-[tert-butyl(dimethyl)silyl]oxy-6-methylnona-3,5-dien-1-ol
CID 102108791
tert-butyl-dimethyl-[(2Z,6E)-6-methylocta-2,6-dienoxy]silane
CID 124629180
tert-butyl-dimethyl-[(E)-4-(5-methylpyrimidin-2-yl)but-3-enoxy]silane
CID 153429891
[(E)-7-bromooct-6-enoxy]-tert-butyl-dimethylsilane
CID 135007678
tert-butyl-dimethyl-[(Z)-2-methylhex-2-enoxy]silane
CID 89381539

Frequently Asked Questions

What is the IUPAC name of (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol?
The IUPAC name of (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol (CID 10061716) is (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol.
What is the SMILES notation for (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol?
The canonical SMILES for (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol is C/C(=C\C/C=C/CCO[Si](C)(C)C(C)(C)C)CO.
What is the InChIKey of (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol?
The InChIKey is XMHFSTLQQJSTMP-DQBULIGTSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-14(13-16)11-9-7-8-10-12-17-18(5,6)15(2,3)4/h7-8,11,16H,9-10,12-13H2,1-6H3/b8-7+,14-11+.
What are the key properties of (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol?
(2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol has a molecular weight of 270.49 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,5E)-8-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,5-dien-1-ol is sourced from PubChem (CID 10061716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).