[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane

C12H21F3OSi — CID 11043721

IUPAC[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane
SMILESC[Si](C)(C)/C=C(/OC1CCCCC1)C(F)(F)F
InChIInChI=1S/C12H21F3OSi/c1-17(2,3)9-11(12(13,14)15)16-10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3/b11-9+
InChIKeyIXOPELMNOQHUOX-PKNBQFBNSA-N
MW266.38 g/mol
LogP4.66
Rot. Bonds3

About [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane

[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane (PubChem CID 11043721) has the molecular formula C12H21F3OSi and a molecular weight of 266.38 g/mol. Its IUPAC name is [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane
PubChem CID11043721
Molecular FormulaC12H21F3OSi
Molecular Weight266.38 g/mol
Exact Mass266.13
IUPAC Name[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane
SMILESC[Si](C)(C)/C=C(/OC1CCCCC1)C(F)(F)F
InChIInChI=1S/C12H21F3OSi/c1-17(2,3)9-11(12(13,14)15)16-10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3/b11-9+
InChIKeyIXOPELMNOQHUOX-PKNBQFBNSA-N
XLogP4.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.66
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'}

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Related Compounds

cyclohexyl 2-trimethylsilylprop-2-enoate
CID 139634302
[(Z)-1-cyclohexyloxy-2,3,3,3-tetrafluoroprop-1-enyl]cyclohexane
CID 11055493
cycloheptyl 2-bromo-2,2-difluoroacetate
CID 135281025
cyclooctyl carbonochloridate;ethane
CID 144532416
1-O-cyclohexyl 4-O-trimethylsilyl (E)-but-2-enedioate
CID 19864022
[(E)-prop-1-enoxy]cyclododecane
CID 5374044
cycloheptadecyl acetate
CID 57215828
cyclohexyl (2R)-2-(trifluoromethyl)oxirane-2-carboxylate
CID 87994580
(4-cyclohexylcyclohexyl) 2,2,2-trifluoroacetate
CID 91692563
2-chloropropan-2-yl cyclohexyl carbonate
CID 163283556
cycloheptyl 2-methyl-2-(trifluoromethyl)butanoate
CID 59422991
dicyclononyl carbonate
CID 139618210

Frequently Asked Questions

What is the IUPAC name of [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane?
The IUPAC name of [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane (CID 11043721) is [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane.
What is the SMILES notation for [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane?
The canonical SMILES for [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane is C[Si](C)(C)/C=C(/OC1CCCCC1)C(F)(F)F.
What is the InChIKey of [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane?
The InChIKey is IXOPELMNOQHUOX-PKNBQFBNSA-N. The full InChI is InChI=1S/C12H21F3OSi/c1-17(2,3)9-11(12(13,14)15)16-10-7-5-4-6-8-10/h9-10H,4-8H2,1-3H3/b11-9+.
What are the key properties of [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane?
[(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane has a molecular weight of 266.38 g/mol, XLogP of 4.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-cyclohexyloxy-3,3,3-trifluoroprop-1-enyl]-trimethylsilane is sourced from PubChem (CID 11043721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).