[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate

C14H30O2Si2 — CID 134966721

IUPAC[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate
SMILESCC(=O)OCCCC/C(=C/[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H30O2Si2/c1-13(15)16-11-9-8-10-14(18(5,6)7)12-17(2,3)4/h12H,8-11H2,1-7H3/b14-12-
InChIKeyKCFXXZBXEUVERN-OWBHPGMISA-N
MW286.56 g/mol
LogP4.40
Rot. Bonds7

About [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate

[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate (PubChem CID 134966721) has the molecular formula C14H30O2Si2 and a molecular weight of 286.56 g/mol. Its IUPAC name is [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate.

Molecular Properties

Compound Name[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate
PubChem CID134966721
Molecular FormulaC14H30O2Si2
Molecular Weight286.56 g/mol
Exact Mass286.18
IUPAC Name[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate
SMILESCC(=O)OCCCC/C(=C/[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H30O2Si2/c1-13(15)16-11-9-8-10-14(18(5,6)7)12-17(2,3)4/h12H,8-11H2,1-7H3/b14-12-
InChIKeyKCFXXZBXEUVERN-OWBHPGMISA-N
XLogP4.40
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.56
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Pentenoic acid, 4-[(trimethylsilyl)methyl]-, ethyl ester
CID 11020263
[(E)-6-triethoxysilylhex-5-enyl] acetate
CID 11324172
4-Trimethylsilylhex-5-en-2-yl acetate
CID 12865712
4-(2,2,5,5-Tetramethyl-1,2,5-oxadisilol-3-yl)butyl acetate
CID 53483590
[(E)-6-[tert-butyl(dimethyl)silyl]oxyhex-5-enyl] acetate
CID 134944492
[(Z)-5-trimethylsilylpent-4-enyl] acetate
CID 59990255
3-Trimethylsilylbut-3-enyl acetate
CID 10442441
4-[Diethoxy(methyl)silyl]pent-4-enyl acetate
CID 12014239
ethyl (E)-6-trimethylsilylhex-5-enoate
CID 13793876
[(E)-5-trimethylsilylpent-4-enyl] acetate
CID 20765107
[(Z)-6-triethoxysilylhex-5-enyl] acetate
CID 101049480
4-Triethylsilylpent-4-enyl acetate
CID 101383505

Frequently Asked Questions

What is the IUPAC name of [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate?
The IUPAC name of [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate (CID 134966721) is [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate.
What is the SMILES notation for [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate?
The canonical SMILES for [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate is CC(=O)OCCCC/C(=C/[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate?
The InChIKey is KCFXXZBXEUVERN-OWBHPGMISA-N. The full InChI is InChI=1S/C14H30O2Si2/c1-13(15)16-11-9-8-10-14(18(5,6)7)12-17(2,3)4/h12H,8-11H2,1-7H3/b14-12-.
What are the key properties of [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate?
[(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate has a molecular weight of 286.56 g/mol, XLogP of 4.40, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5,6-bis(trimethylsilyl)hex-5-enyl] acetate is sourced from PubChem (CID 134966721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).