tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane

C17H32OSi — CID 135073519

IUPACtert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane
SMILESC=CCCC/C=C(/C)C1(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C17H32OSi/c1-8-9-10-11-12-15(2)17(13-14-17)18-19(6,7)16(3,4)5/h8,12H,1,9-11,13-14H2,2-7H3/b15-12-
InChIKeyCAKZWIJJQXWJAI-QINSGFPZSA-N
MW280.53 g/mol
LogP5.84
Rot. Bonds7

About tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane

tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane (PubChem CID 135073519) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane
PubChem CID135073519
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Nametert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane
SMILESC=CCCC/C=C(/C)C1(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C17H32OSi/c1-8-9-10-11-12-15(2)17(13-14-17)18-19(6,7)16(3,4)5/h8,12H,1,9-11,13-14H2,2-7H3/b15-12-
InChIKeyCAKZWIJJQXWJAI-QINSGFPZSA-N
XLogP5.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane with MolForge

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Related Compounds

tert-butyl-[1-[(2Z)-5,5-dimethylocta-2,7-dien-2-yl]cyclopropyl]oxy-dimethylsilane
CID 24862243
3,7-Dimethylocta-1,6-dien-3-ylperoxy(triethyl)silane
CID 90876188
tert-butyl-[1-[(2E)-5,5-dimethylocta-2,7-dien-2-yl]cyclopropyl]oxy-dimethylsilane
CID 134844444
tert-butyl-[1-[(2Z)-5,5-dimethylhepta-2,6-dien-2-yl]cyclopropyl]oxy-dimethylsilane
CID 134963682
t-Butyl(1,5-dimethyl-1-vinylhex-4-enyloxy)dimethylsilane
CID 554425
trimethyl-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]oxysilane
CID 15602253
tert-butyl-[1-[(1E)-3-[tert-butyl(dimethyl)silyl]oxybuta-1,3-dienyl]cyclopropyl]oxy-dimethylsilane
CID 58932359
Tert-butyl-[1-[3-[tert-butyl(dimethyl)silyl]oxybuta-1,3-dienyl]cyclopropyl]oxy-dimethylsilane
CID 72466901
triethyl-[(1E)-4-methyl-1-tributylstannylocta-1,5-dien-4-yl]oxysilane
CID 88790838
tert-butyl-dimethyl-[(E)-3-methylhex-4-en-3-yl]oxysilane
CID 141142275
[(3,7-Dimethylocta-1,6-dien-3-yl)oxy](triethyl)silane
CID 13159085
[(3Z)-2,6-dimethyl-5-propan-2-ylhepta-3,5-dien-2-yl]oxy-triethylsilane
CID 15441002

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane (CID 135073519) is tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane is C=CCCC/C=C(/C)C1(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane?
The InChIKey is CAKZWIJJQXWJAI-QINSGFPZSA-N. The full InChI is InChI=1S/C17H32OSi/c1-8-9-10-11-12-15(2)17(13-14-17)18-19(6,7)16(3,4)5/h8,12H,1,9-11,13-14H2,2-7H3/b15-12-.
What are the key properties of tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane?
tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane has a molecular weight of 280.53 g/mol, XLogP of 5.84, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[1-[(2Z)-octa-2,7-dien-2-yl]cyclopropyl]oxysilane is sourced from PubChem (CID 135073519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).