tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane

C16H32OSi — CID 134978982

IUPACtert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane
SMILESCC1(C)CCC/C(=C/CO[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C16H32OSi/c1-15(2,3)18(6,7)17-12-10-14-9-8-11-16(4,5)13-14/h10H,8-9,11-13H2,1-7H3/b14-10-
InChIKeyXBLOMPGIGBKVBE-UVTDQMKNSA-N
MW268.52 g/mol
LogP5.53
Rot. Bonds3

About tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane

tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane (PubChem CID 134978982) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane
PubChem CID134978982
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane
SMILESCC1(C)CCC/C(=C/CO[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C16H32OSi/c1-15(2,3)18(6,7)17-12-10-14-9-8-11-16(4,5)13-14/h10H,8-9,11-13H2,1-7H3/b14-10-
InChIKeyXBLOMPGIGBKVBE-UVTDQMKNSA-N
XLogP5.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Trimethylsiloxy-3,7,11,15-tetramethyl-2-hexadecene
CID 5372684
Retin, 15-[(trimethylsilyl)oxy]-, (11-cis,13-cis)-
CID 165362841
Phytyl tms ether
CID 129725731
tert-butyl-[(2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoxy]-dimethylsilane
CID 10905468
[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoxy]-trimethylsilane
CID 5366575
Silane, (1,1-dimethylethyl)dimethyl[[2-methyl-3-(2,6,6-trimethyl-2-cyclohexen-1-ylidene)-1-propenyl]oxy]-
CID 5366892
tert-butyl-[(2E,7E)-4-tert-butyl-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,5,7-tetraenoxy]-dimethylsilane
CID 10884955
[(E,2E)-2-(2-bromoethylidene)-6-methyl-8-(2,6,6-trimethylcyclohexen-1-yl)oct-5-enoxy]-tert-butyl-dimethylsilane
CID 11092087
tert-butyl-dimethyl-[(2E,4Z,6E)-3-methyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6-trienoxy]silane
CID 21729900
2-Hexadecen-1-ol, 3,7,11,15-tetramethyl-, (2Z)-, tert-butyldimethylsilyl ether
CID 91697215
2-Hexadecen-1-ol, 3,7,11,15-tetramethyl-, (2E)-, tert-butyldimethylsilyl ether
CID 91697372
[3,7-Dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoxy]-trimethylsilane
CID 552930

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane (CID 134978982) is tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane is CC1(C)CCC/C(=C/CO[Si](C)(C)C(C)(C)C)C1.
What is the InChIKey of tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane?
The InChIKey is XBLOMPGIGBKVBE-UVTDQMKNSA-N. The full InChI is InChI=1S/C16H32OSi/c1-15(2,3)18(6,7)17-12-10-14-9-8-11-16(4,5)13-14/h10H,8-9,11-13H2,1-7H3/b14-10-.
What are the key properties of tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane?
tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane has a molecular weight of 268.52 g/mol, XLogP of 5.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2Z)-2-(3,3-dimethylcyclohexylidene)ethoxy]-dimethylsilane is sourced from PubChem (CID 134978982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).