(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol

C10H20OSi — CID 12935881

IUPAC(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol
SMILESC/C=C(\C)C(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-9(2)10(11)7-8-12(3,4)5/h6-8,10-11H,1-5H3/b8-7+,9-6+
InChIKeyVUJCZPPTXWVGOS-KHHFIZIMSA-N
MW184.35 g/mol
LogP2.75
Rot. Bonds3

About (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol

(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol (PubChem CID 12935881) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol.

Molecular Properties

Compound Name(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol
PubChem CID12935881
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol
SMILESC/C=C(\C)C(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-9(2)10(11)7-8-12(3,4)5/h6-8,10-11H,1-5H3/b8-7+,9-6+
InChIKeyVUJCZPPTXWVGOS-KHHFIZIMSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol with MolForge

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Related Compounds

2-Cyclopenten-1-ol, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, cis-
CID 10176747
(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-en-1-ol
CID 12194985
(Z)-2-methyl-3-(trimethylsilylmethyl)oct-3-ene-2,7-diol
CID 13508268
(E)-2-methyl-7-trimethylsilylhept-2-en-6-yn-1-ol
CID 134981587
(E)-6-[tert-butyl(dimethyl)silyl]oxyhex-2-en-1-ol
CID 10489670
Rel-(1R,4S)-4-((tert-butyldimethylsilyl)oxy)cyclopent-2-en-1-ol
CID 10910904
(1S,4S)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-ol
CID 11020261
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-fluorohex-4-en-3-ol
CID 141121837
(1r, 3r)-1-(Tert-butyl-dimethylsiloxy)-3-hydroxy-4-cyclopentene
CID 10878531
(Z,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-en-1-ol
CID 10488936
(Z)-2-ethyl-5-trimethylsilylpent-2-en-4-yn-1-ol
CID 10749960
(Z)-8-trimethylsilyloct-5-en-7-yn-4-ol
CID 10797972

Frequently Asked Questions

What is the IUPAC name of (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol?
The IUPAC name of (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol (CID 12935881) is (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol.
What is the SMILES notation for (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol?
The canonical SMILES for (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol is C/C=C(\C)C(O)/C=C/[Si](C)(C)C.
What is the InChIKey of (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol?
The InChIKey is VUJCZPPTXWVGOS-KHHFIZIMSA-N. The full InChI is InChI=1S/C10H20OSi/c1-6-9(2)10(11)7-8-12(3,4)5/h6-8,10-11H,1-5H3/b8-7+,9-6+.
What are the key properties of (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol?
(1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol has a molecular weight of 184.35 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,4E)-4-methyl-1-trimethylsilylhexa-1,4-dien-3-ol is sourced from PubChem (CID 12935881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).