tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane

C17H32OSi — CID 102123642

IUPACtert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane
SMILESC=C1CC(CO[Si](C)(C)C(C)(C)C)C/C1=C\CCC
InChIInChI=1S/C17H32OSi/c1-8-9-10-16-12-15(11-14(16)2)13-18-19(6,7)17(3,4)5/h10,15H,2,8-9,11-13H2,1,3-7H3/b16-10+
InChIKeyRRMVNZKSSVXPBA-MHWRWJLKSA-N
MW280.53 g/mol
LogP5.70
Rot. Bonds5

About tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane

tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane (PubChem CID 102123642) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane
PubChem CID102123642
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Nametert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane
SMILESC=C1CC(CO[Si](C)(C)C(C)(C)C)C/C1=C\CCC
InChIInChI=1S/C17H32OSi/c1-8-9-10-16-12-15(11-14(16)2)13-18-19(6,7)17(3,4)5/h10,15H,2,8-9,11-13H2,1,3-7H3/b16-10+
InChIKeyRRMVNZKSSVXPBA-MHWRWJLKSA-N
XLogP5.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Silane, [(3,7-dimethyl-6-octenyl)oxy]trimethyl-
CID 557338
tert-butyl-dimethyl-[(2R,3R)-2,3,6-trimethylhept-5-enoxy]silane
CID 154722229
(S)-tert-butyl((3,7-dimethyloct-6-en-1-yl)oxy)dimethylsilane
CID 22882877
beta-Citronellol, TBDMS derivative
CID 11043851
bis[(3,7-Dimethyloct-6-en-1-yl)oxy](dimethyl)silane
CID 91697684
3,7-Dimethyloct-6-enoxy(triethyl)silane
CID 72751260
Tert-butyl(dimethyl)silyl (3R)-3,7-dimethyl-6-octenyl ether
CID 14336178
[(5E)-4-[(1E)-buta-1,3-dienyl]octa-5,7-dienoxy]-tert-butyl-dimethylsilane
CID 102150886
tert-butyl-[(3S)-3,11-dimethyldodec-10-en-6-ynoxy]-dimethylsilane
CID 134844349
lithium [(2S)-2-[(1S)-4-methylcyclohexa-2,4-dien-1-yl]propoxy]-tri(propan-2-yl)silane
CID 134942751
tert-butyl-[(E,2R)-4-ethyl-2-methylhept-4-enoxy]-dimethylsilane
CID 134963593
tert-butyl-[(5E)-5-[(2E)-2-ethylidenecyclopentylidene]pentoxy]-dimethylsilane
CID 134982740

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane (CID 102123642) is tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane is C=C1CC(CO[Si](C)(C)C(C)(C)C)C/C1=C\CCC.
What is the InChIKey of tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane?
The InChIKey is RRMVNZKSSVXPBA-MHWRWJLKSA-N. The full InChI is InChI=1S/C17H32OSi/c1-8-9-10-16-12-15(11-14(16)2)13-18-19(6,7)17(3,4)5/h10,15H,2,8-9,11-13H2,1,3-7H3/b16-10+.
What are the key properties of tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane?
tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane has a molecular weight of 280.53 g/mol, XLogP of 5.70, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(3E)-3-butylidene-4-methylidenecyclopentyl]methoxy]-dimethylsilane is sourced from PubChem (CID 102123642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).