tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane

C18H34OSi — CID 5366649

IUPACtert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane
SMILESC=C1CCCC(C)(C)C1C/C=C\O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H34OSi/c1-15-11-9-13-18(5,6)16(15)12-10-14-19-20(7,8)17(2,3)4/h10,14,16H,1,9,11-13H2,2-8H3/b14-10-
InChIKeyAOGIIZUFWBNGIN-UVTDQMKNSA-N
MW294.56 g/mol
LogP6.29
Rot. Bonds4

About tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane

tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane (PubChem CID 5366649) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane
PubChem CID5366649
Molecular FormulaC18H34OSi
Molecular Weight294.56 g/mol
Exact Mass294.24
IUPAC Nametert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane
SMILESC=C1CCCC(C)(C)C1C/C=C\O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H34OSi/c1-15-11-9-13-18(5,6)16(15)12-10-14-19-20(7,8)17(2,3)4/h10,14,16H,1,9,11-13H2,2-8H3/b14-10-
InChIKeyAOGIIZUFWBNGIN-UVTDQMKNSA-N
XLogP6.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.56
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-[(1S,2R,6S)-1,2-dimethyl-6-prop-2-enylcyclohexyl]prop-1-ynoxy-tri(propan-2-yl)silane
CID 11233807
Tert-butyl-[2-(2,2-dimethyl-6-methylidenecyclohexyl)ethoxy]-dimethylsilane
CID 14563308
t-Butyl-[4-(2,2-dimethyl-6-methylene-cyclohexyl)-but-1-enyloxy]-dimethyl-silane
CID 5366436
t-Butyl-[3-(2,2-dimethyl-6-methylenecyclohexyl)propenyloxy]dimethylsilane
CID 5366648
2-Cyclohexylhex-5-enyl(triethoxy)silane
CID 20026947
2-[1,2-Bis(ethenyl)cyclohexyl]ethyl-triethoxysilane
CID 66694493
(2-Triethoxysilylethyl)divinylcyclohexane
CID 66694494
3-Cyclohexylhept-6-en-2-yl(triethoxy)silane
CID 66694737
2-[3,4-Bis(ethenyl)cyclohexyl]ethyl-triethoxysilane
CID 69670313
4-Cyclohexylhexa-1,5-dien-3-yl(triethoxy)silane
CID 91315963
tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane
CID 139775020
CID 145777063
CID 145777063

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane (CID 5366649) is tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane is C=C1CCCC(C)(C)C1C/C=C\O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane?
The InChIKey is AOGIIZUFWBNGIN-UVTDQMKNSA-N. The full InChI is InChI=1S/C18H34OSi/c1-15-11-9-13-18(5,6)16(15)12-10-14-19-20(7,8)17(2,3)4/h10,14,16H,1,9,11-13H2,2-8H3/b14-10-.
What are the key properties of tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane?
tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane has a molecular weight of 294.56 g/mol, XLogP of 6.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(Z)-3-(2,2-dimethyl-6-methylidenecyclohexyl)prop-1-enoxy]-dimethylsilane is sourced from PubChem (CID 5366649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).