tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane

C20H38OSi2 — CID 134982626

IUPACtert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
SMILESCCC(=C/[C@@H](C)CO[Si](C)(C)C(C)(C)C)/C=C/C#C[Si](C)(C)C
InChIInChI=1S/C20H38OSi2/c1-11-19(14-12-13-15-22(6,7)8)16-18(2)17-21-23(9,10)20(3,4)5/h12,14,16,18H,11,17H2,1-10H3/b14-12+,19-16-/t18-/m1/s1
InChIKeyAWASKOGIFOOVKS-XNRIIQFKSA-N
MW350.70 g/mol
LogP6.42
Rot. Bonds6

About tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane

tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane (PubChem CID 134982626) has the molecular formula C20H38OSi2 and a molecular weight of 350.70 g/mol. Its IUPAC name is tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
PubChem CID134982626
Molecular FormulaC20H38OSi2
Molecular Weight350.70 g/mol
Exact Mass350.25
IUPAC Nametert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
SMILESCCC(=C/[C@@H](C)CO[Si](C)(C)C(C)(C)C)/C=C/C#C[Si](C)(C)C
InChIInChI=1S/C20H38OSi2/c1-11-19(14-12-13-15-22(6,7)8)16-18(2)17-21-23(9,10)20(3,4)5/h12,14,16,18H,11,17H2,1-10H3/b14-12+,19-16-/t18-/m1/s1
InChIKeyAWASKOGIFOOVKS-XNRIIQFKSA-N
XLogP6.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.70
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(3E,5E,7E,9E)-dodeca-3,5,7,9-tetraen-11-ynoxy]-tri(propan-2-yl)silane
CID 10882108
tert-butyl-[(2R,3E,5E)-4-ethenyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
CID 11163885
tert-butyl-[(2R,3E,5E)-2,4-dimethyldeca-3,5-dienoxy]-dimethylsilane
CID 11208696
tert-butyl-dimethyl-[(2S,3E,5E,7E,9E)-2-methyldodeca-3,5,7,9-tetraen-11-ynoxy]silane
CID 11220389
[(4Z,6E)-7,11-dimethyldodeca-4,6,10-trienoxy]-tri(propan-2-yl)silane
CID 11279999
tert-butyl-[(2R,3Z,5E)-4-ethynyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
CID 11336947
tert-butyl-dimethyl-[(2S,3E,5E)-2-methylocta-3,5-dien-7-ynoxy]silane
CID 11345720
tert-butyl-dimethyl-[(E)-3-methyl-8-trimethylsilyloct-3-en-7-ynoxy]silane
CID 11438740
[(3E,5Z,7R)-5-bromo-8-[tert-butyl(dimethyl)silyl]oxy-7-methylocta-3,5-dien-1-ynyl]-trimethylsilane
CID 11475115
tert-butyl-[(2E,4Z,6R)-4-ethyl-6-methyl-9-trimethylsilylnona-2,4-dien-8-ynoxy]-dimethylsilane
CID 11653482
tert-butyl-[(3E,5E,7E)-deca-3,5,7-trien-9-ynoxy]-dimethylsilane
CID 12073746
Tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane
CID 24795264

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane (CID 134982626) is tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane is CCC(=C/[C@@H](C)CO[Si](C)(C)C(C)(C)C)/C=C/C#C[Si](C)(C)C.
What is the InChIKey of tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane?
The InChIKey is AWASKOGIFOOVKS-XNRIIQFKSA-N. The full InChI is InChI=1S/C20H38OSi2/c1-11-19(14-12-13-15-22(6,7)8)16-18(2)17-21-23(9,10)20(3,4)5/h12,14,16,18H,11,17H2,1-10H3/b14-12+,19-16-/t18-/m1/s1.
What are the key properties of tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane?
tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane has a molecular weight of 350.70 g/mol, XLogP of 6.42, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane is sourced from PubChem (CID 134982626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).