(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane

C13H27FSi2 — CID 597120

IUPAC(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane
SMILESCC1(C)CC=CC([Si](C)(C)C)([Si](C)(C)F)C1
InChIInChI=1S/C13H27FSi2/c1-12(2)9-8-10-13(11-12,15(3,4)5)16(6,7)14/h8,10H,9,11H2,1-7H3
InChIKeyGWPJORICKAOHCD-UHFFFAOYSA-N
MW258.53 g/mol
LogP5.16
Rot. Bonds2

About (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane

(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane (PubChem CID 597120) has the molecular formula C13H27FSi2 and a molecular weight of 258.53 g/mol. Its IUPAC name is (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane.

Molecular Properties

Compound Name(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane
PubChem CID597120
Molecular FormulaC13H27FSi2
Molecular Weight258.53 g/mol
Exact Mass258.16
IUPAC Name(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane
SMILESCC1(C)CC=CC([Si](C)(C)C)([Si](C)(C)F)C1
InChIInChI=1S/C13H27FSi2/c1-12(2)9-8-10-13(11-12,15(3,4)5)16(6,7)14/h8,10H,9,11H2,1-7H3
InChIKeyGWPJORICKAOHCD-UHFFFAOYSA-N
XLogP5.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.53
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(4-Tert-butyl-1-cyclohexen-1-yl)(trimethyl)silane
CID 11052929
Trimethyl-2-(3-cyclohexenyl)ethylsilane
CID 23261216
(4,4-Dimethylcyclohexen-1-yl)-trimethylsilane
CID 12668514
1-t-Butyl-5-trimethylsilyl-1,3-cyclohexadiene
CID 14984258
2-Dimethylsilyl(trimethylsilylpropyl)bicyclo[2,2 .1]hepta-2,5-diene
CID 129694463
(E)-(2-(cyclohex-3-en-1-yl)vinyl)triethylsilane
CID 154701887
Silane, (4-ethenyl-1-cyclohexene-1,4-diyl)bis[trimethyl-
CID 552115
Trimethyl-[1-(4-trimethylsilylcyclohex-3-en-1-yl)ethenyl]silane
CID 21718535
(1-Ethenyl-3-trimethylsilylcyclohex-3-en-1-yl)-trimethylsilane
CID 21720098
Trimethyl-[1-(3-trimethylsilylcyclohex-3-en-1-yl)ethenyl]silane
CID 21720581
(6,6-Dimethyl-1-cyclohexen-1-yl)(trimethyl)silane
CID 12658227
(5,5-Dimethylcyclohexen-1-yl)-trimethylsilane
CID 12668516

Frequently Asked Questions

What is the IUPAC name of (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane?
The IUPAC name of (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane (CID 597120) is (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane.
What is the SMILES notation for (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane?
The canonical SMILES for (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane is CC1(C)CC=CC([Si](C)(C)C)([Si](C)(C)F)C1.
What is the InChIKey of (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane?
The InChIKey is GWPJORICKAOHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27FSi2/c1-12(2)9-8-10-13(11-12,15(3,4)5)16(6,7)14/h8,10H,9,11H2,1-7H3.
What are the key properties of (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane?
(5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane has a molecular weight of 258.53 g/mol, XLogP of 5.16, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5,5-dimethyl-1-trimethylsilylcyclohex-2-en-1-yl)-fluoro-dimethylsilane is sourced from PubChem (CID 597120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).