(5E)-3-trimethylsilylhepta-1,5-dien-4-ol

C10H20OSi — CID 13039868

IUPAC(5E)-3-trimethylsilylhepta-1,5-dien-4-ol
SMILESC=CC(C(O)/C=C/C)[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-8-9(11)10(7-2)12(3,4)5/h6-11H,2H2,1,3-5H3/b8-6+
InChIKeyXHLLULWYKMVZON-SOFGYWHQSA-N
MW184.35 g/mol
LogP2.82
Rot. Bonds4

About (5E)-3-trimethylsilylhepta-1,5-dien-4-ol

(5E)-3-trimethylsilylhepta-1,5-dien-4-ol (PubChem CID 13039868) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is (5E)-3-trimethylsilylhepta-1,5-dien-4-ol.

Molecular Properties

Compound Name(5E)-3-trimethylsilylhepta-1,5-dien-4-ol
PubChem CID13039868
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name(5E)-3-trimethylsilylhepta-1,5-dien-4-ol
SMILESC=CC(C(O)/C=C/C)[Si](C)(C)C
InChIInChI=1S/C10H20OSi/c1-6-8-9(11)10(7-2)12(3,4)5/h6-11H,2H2,1,3-5H3/b8-6+
InChIKeyXHLLULWYKMVZON-SOFGYWHQSA-N
XLogP2.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.82
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'}

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Related Compounds

5-(Trimethylsilyl)pent-3-en-1-ol
CID 13837971
(5Z,8Z)-1,5,8-undecatriene-3,7-diol
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(E)-oct-4-en-3-ol
CID 12424084
(E)-3-fluoro-1-tri(propan-2-yl)silylhept-5-en-1-yn-4-ol
CID 10517217
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
(Z)-2-trimethylsilylhept-2-en-1-ol
CID 11745353
(E,4S)-4-[tert-butyl(dimethyl)silyl]oxypent-2-en-1-ol
CID 12194985
(5E)-nona-1,5-dien-4-ol
CID 10931514
4-Octen-3-ol
CID 54545745
Deca-4,8-dien-3-ol
CID 129774584
Undeca-1,5,8-trien-3-ol
CID 71360907
6-[Tert-butyl(dimethyl)silyl]-3,6-difluorocyclohexa-2,4-dien-1-ol
CID 140981349

Frequently Asked Questions

What is the IUPAC name of (5E)-3-trimethylsilylhepta-1,5-dien-4-ol?
The IUPAC name of (5E)-3-trimethylsilylhepta-1,5-dien-4-ol (CID 13039868) is (5E)-3-trimethylsilylhepta-1,5-dien-4-ol.
What is the SMILES notation for (5E)-3-trimethylsilylhepta-1,5-dien-4-ol?
The canonical SMILES for (5E)-3-trimethylsilylhepta-1,5-dien-4-ol is C=CC(C(O)/C=C/C)[Si](C)(C)C.
What is the InChIKey of (5E)-3-trimethylsilylhepta-1,5-dien-4-ol?
The InChIKey is XHLLULWYKMVZON-SOFGYWHQSA-N. The full InChI is InChI=1S/C10H20OSi/c1-6-8-9(11)10(7-2)12(3,4)5/h6-11H,2H2,1,3-5H3/b8-6+.
What are the key properties of (5E)-3-trimethylsilylhepta-1,5-dien-4-ol?
(5E)-3-trimethylsilylhepta-1,5-dien-4-ol has a molecular weight of 184.35 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-3-trimethylsilylhepta-1,5-dien-4-ol is sourced from PubChem (CID 13039868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).