tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane

C18H36O2Si2 — CID 19094823

IUPACtert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1=CCCC=C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36O2Si2/c1-17(2,3)21(7,8)19-15-13-11-12-14-16(15)20-22(9,10)18(4,5)6/h13-14H,11-12H2,1-10H3
InChIKeyPMBXKVIONIDKFA-UHFFFAOYSA-N
MW340.66 g/mol
LogP6.59
Rot. Bonds4

About tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane

tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane (PubChem CID 19094823) has the molecular formula C18H36O2Si2 and a molecular weight of 340.66 g/mol. Its IUPAC name is tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane
PubChem CID19094823
Molecular FormulaC18H36O2Si2
Molecular Weight340.66 g/mol
Exact Mass340.23
IUPAC Nametert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1=CCCC=C1O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H36O2Si2/c1-17(2,3)21(7,8)19-15-13-11-12-14-16(15)20-22(9,10)18(4,5)6/h13-14H,11-12H2,1-10H3
InChIKeyPMBXKVIONIDKFA-UHFFFAOYSA-N
XLogP6.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.66
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-Bis(trimethylsilyloxy)-1,3-cyclohexadiene
CID 12528296
Tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxycyclopenta-1,4-dien-1-yl]oxy-dimethylsilane
CID 23115136
bis[[(3S)-3-ethenylcyclohexa-1,5-dien-1-yl]oxy]-di(propan-2-yl)silane
CID 134852037
tert-butyl-dimethyl-[(2E,6E)-3-methyl-1-(2-methylprop-1-enylidene)-7-trimethylsilyloxynona-2,6,8-trienoxy]silane
CID 134885223
Triisopropyl((6-methylcyclohexa-1,5-dien-1-yl)oxy)silane
CID 164887903
2-Methyl-3,5-heptadiene, 7-trimethylsilyl-2,3-bis(trimethylsilyloxy)-
CID 5366578
Trimethyl-(2-methyl-5-trimethylsilyloxycyclopenta-1,4-dien-1-yl)oxysilane
CID 14323384
[3,4-Bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane
CID 23115134
[5-[Dimethyl(propan-2-yl)silyl]oxycyclopenta-1,4-dien-1-yl]oxy-dimethyl-propan-2-ylsilane
CID 23115141
Trimethyl-(3-trimethylsilyl-5-trimethylsilyloxycyclopenta-1,4-dien-1-yl)oxysilane
CID 23115144
[3,4-Bis[[tert-butyl(dimethyl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane
CID 23115147
Tri(propan-2-yl)-[(5,5,6-trimethyl-5-silabicyclo[2.1.1]hexa-1(6),2-dien-2-yl)oxy]silane
CID 91267723

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane (CID 19094823) is tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1=CCCC=C1O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane?
The InChIKey is PMBXKVIONIDKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O2Si2/c1-17(2,3)21(7,8)19-15-13-11-12-14-16(15)20-22(9,10)18(4,5)6/h13-14H,11-12H2,1-10H3.
What are the key properties of tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane?
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane has a molecular weight of 340.66 g/mol, XLogP of 6.59, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,5-dien-1-yl]oxy-dimethylsilane is sourced from PubChem (CID 19094823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).