trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane

C12H24Si — CID 134993479

IUPACtrimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane
SMILESC/C=C/C=C\[C@H](C(C)C)[Si](C)(C)C
InChIInChI=1S/C12H24Si/c1-7-8-9-10-12(11(2)3)13(4,5)6/h7-12H,1-6H3/b8-7+,10-9-/t12-/m1/s1
InChIKeyHJWFEYIQCOPNEV-HLLOTYCESA-N
MW196.41 g/mol
LogP4.48
Rot. Bonds4

About trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane

trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane (PubChem CID 134993479) has the molecular formula C12H24Si and a molecular weight of 196.41 g/mol. Its IUPAC name is trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane
PubChem CID134993479
Molecular FormulaC12H24Si
Molecular Weight196.41 g/mol
Exact Mass196.16
IUPAC Nametrimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane
SMILESC/C=C/C=C\[C@H](C(C)C)[Si](C)(C)C
InChIInChI=1S/C12H24Si/c1-7-8-9-10-12(11(2)3)13(4,5)6/h7-12H,1-6H3/b8-7+,10-9-/t12-/m1/s1
InChIKeyHJWFEYIQCOPNEV-HLLOTYCESA-N
XLogP4.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.41
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Silane, trimethyl[1-(1-methylethenyl)-1-butenyl]-, (E)-
CID 5366644
trimethyl-[(E)-4-methylpent-2-enyl]silane
CID 10986493
5-Methyl-2,6-cis-heptadienyltrimethylsilane
CID 12550622
trimethyl-[(Z)-4-methylpent-2-enyl]silane
CID 13530519
[(2E)-5,6-dimethylhepta-2,5-dienyl]-trimethylsilane
CID 101546838
[(2E)-4,5-dimethylhexa-2,4-dienyl]-trimethylsilane
CID 102473316
trimethyl-[(1E,3E)-3-methylhexa-1,3-dienyl]silane
CID 10535131
[(1E,3E)-hepta-1,3-dienyl]-trimethylsilane
CID 12494006
Cyclohexa-1,5-dien-1-yl(trimethyl)silane
CID 12934073
Trimethyl-(3-propan-2-ylidenecyclopenta-1,4-dien-1-yl)silane
CID 18347611
Cyclohexa-2,4-dien-1-yl(trimethyl)silane
CID 18787990
Bis(trimethylsilyl)cyclohexadiene
CID 23335053

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane?
The IUPAC name of trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane (CID 134993479) is trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane.
What is the SMILES notation for trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane?
The canonical SMILES for trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane is C/C=C/C=C\[C@H](C(C)C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane?
The InChIKey is HJWFEYIQCOPNEV-HLLOTYCESA-N. The full InChI is InChI=1S/C12H24Si/c1-7-8-9-10-12(11(2)3)13(4,5)6/h7-12H,1-6H3/b8-7+,10-9-/t12-/m1/s1.
What are the key properties of trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane?
trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane has a molecular weight of 196.41 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3S,4Z,6E)-2-methylocta-4,6-dien-3-yl]silane is sourced from PubChem (CID 134993479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).