[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol

C11H22OSi — CID 14961487

IUPAC[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol
SMILESCC1=C[C@H]([Si](C)(C)C)CC[C@H]1CO
InChIInChI=1S/C11H22OSi/c1-9-7-11(13(2,3)4)6-5-10(9)8-12/h7,10-12H,5-6,8H2,1-4H3/t10-,11+/m0/s1
InChIKeyXTYDWAAFZLAOLG-WDEREUQCSA-N
MW198.38 g/mol
LogP3.04
Rot. Bonds2

About [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol

[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol (PubChem CID 14961487) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol.

Molecular Properties

Compound Name[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol
PubChem CID14961487
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol
SMILESCC1=C[C@H]([Si](C)(C)C)CC[C@H]1CO
InChIInChI=1S/C11H22OSi/c1-9-7-11(13(2,3)4)6-5-10(9)8-12/h7,10-12H,5-6,8H2,1-4H3/t10-,11+/m0/s1
InChIKeyXTYDWAAFZLAOLG-WDEREUQCSA-N
XLogP3.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
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

3-(4-Methyl-3-cyclohexen-1-yl)-3-butenol
CID 85905
Limonene-hexanol
CID 18454862
CID 163993340
CID 163993340
3-Cyclohexene-1-methanol, 4-methyl-
CID 564672
3-(6-Trimethylsilylcyclohex-2-en-1-yl)propan-1-ol
CID 10420734
[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol
CID 10976178
3-[(1S)-4-methylcyclohex-3-en-1-yl]but-3-en-1-ol
CID 11205980
[(1R,5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl]methanol
CID 13873231
(2-Trimethylsilylcyclohex-3-en-1-yl)methanol
CID 14961467
(4-Trimethylsilylcyclohex-2-en-1-yl)methanol
CID 14961483
(1R,6R)-4-methyl-6-trimethylsilylcyclohex-3-en-1-ol
CID 14984251
(4E,6E,9Z)-5,8-Dimethyl-4-((trimethylsilyl)methylene)tetradeca-6,9-dien-1-ol
CID 45259142

Frequently Asked Questions

What is the IUPAC name of [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol?
The IUPAC name of [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol (CID 14961487) is [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol.
What is the SMILES notation for [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol?
The canonical SMILES for [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol is CC1=C[C@H]([Si](C)(C)C)CC[C@H]1CO.
What is the InChIKey of [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol?
The InChIKey is XTYDWAAFZLAOLG-WDEREUQCSA-N. The full InChI is InChI=1S/C11H22OSi/c1-9-7-11(13(2,3)4)6-5-10(9)8-12/h7,10-12H,5-6,8H2,1-4H3/t10-,11+/m0/s1.
What are the key properties of [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol?
[(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol has a molecular weight of 198.38 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,4R)-2-methyl-4-trimethylsilylcyclohex-2-en-1-yl]methanol is sourced from PubChem (CID 14961487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).