1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol

C11H22O2Si — CID 71438034

IUPAC1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol
SMILESCC1=CCC(O)C(C)(O)C1[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8-6-7-9(12)11(2,13)10(8)14(3,4)5/h6,9-10,12-13H,7H2,1-5H3
InChIKeyQPPIJMOYVKLLJO-UHFFFAOYSA-N
MW214.38 g/mol
LogP2.16
Rot. Bonds1

About 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol

1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol (PubChem CID 71438034) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol.

Molecular Properties

Compound Name1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol
PubChem CID71438034
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol
SMILESCC1=CCC(O)C(C)(O)C1[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-8-6-7-9(12)11(2,13)10(8)14(3,4)5/h6,9-10,12-13H,7H2,1-5H3
InChIKeyQPPIJMOYVKLLJO-UHFFFAOYSA-N
XLogP2.16
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

Armillariol A
CID 72697109
(1R,2S,3R)-1,3,5-trimethylcyclohex-4-ene-1,2-diol
CID 11263635
[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol
CID 14961487
(1R,6R)-4-methyl-6-trimethylsilylcyclohex-3-en-1-ol
CID 14984251
(1R,6R)-3-methyl-6-trimethylsilylcyclohex-3-en-1-ol
CID 14984252
(1S,2R)-1-ethyl-5-tri(propan-2-yl)silyloxycyclohex-4-ene-1,2-diol
CID 53329014
(1R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-1-(hydroxymethyl)-2-methylcyclopent-2-en-1-ol
CID 135017264
2-(2-Trimethylsilylprop-2-enyl)cyclohex-3-en-1-ol
CID 10846152
(1S,4R,6R)-6-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylcyclohex-2-en-1-ol
CID 11172898
1,3,5-Trimethylcyclohex-4-ene-1,2-diol
CID 72775194
(1S,2S,3S)-3-[tert-butyl(dimethyl)silyl]cyclohex-4-ene-1,2-diol
CID 10878926
3,7-Dimethyloct-6-ene-2,3-diol
CID 15856966

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol?
The IUPAC name of 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol (CID 71438034) is 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol.
What is the SMILES notation for 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol?
The canonical SMILES for 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol is CC1=CCC(O)C(C)(O)C1[Si](C)(C)C.
What is the InChIKey of 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol?
The InChIKey is QPPIJMOYVKLLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-8-6-7-9(12)11(2,13)10(8)14(3,4)5/h6,9-10,12-13H,7H2,1-5H3.
What are the key properties of 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol?
1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol has a molecular weight of 214.38 g/mol, XLogP of 2.16, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6-trimethylsilylcyclohex-4-ene-1,2-diol is sourced from PubChem (CID 71438034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).