[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol

C10H20OSi — CID 10976178

IUPAC[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol
SMILESC[Si](C)(C)[C@@H]1C=CCC[C@@H]1CO
InChIInChI=1S/C10H20OSi/c1-12(2,3)10-7-5-4-6-9(10)8-11/h5,7,9-11H,4,6,8H2,1-3H3/t9-,10-/m1/s1
InChIKeyGDKOJBFWUQDYSJ-NXEZZACHSA-N
MW184.35 g/mol
LogP2.65
Rot. Bonds2

About [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol

[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol (PubChem CID 10976178) has the molecular formula C10H20OSi and a molecular weight of 184.35 g/mol. Its IUPAC name is [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol
PubChem CID10976178
Molecular FormulaC10H20OSi
Molecular Weight184.35 g/mol
Exact Mass184.13
IUPAC Name[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol
SMILESC[Si](C)(C)[C@@H]1C=CCC[C@@H]1CO
InChIInChI=1S/C10H20OSi/c1-12(2,3)10-7-5-4-6-9(10)8-11/h5,7,9-11H,4,6,8H2,1-3H3/t9-,10-/m1/s1
InChIKeyGDKOJBFWUQDYSJ-NXEZZACHSA-N
XLogP2.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.35
LogP ≤ 52.65
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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Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol?
The IUPAC name of [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol (CID 10976178) is [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol.
What is the SMILES notation for [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol?
The canonical SMILES for [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol is C[Si](C)(C)[C@@H]1C=CCC[C@@H]1CO.
What is the InChIKey of [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol?
The InChIKey is GDKOJBFWUQDYSJ-NXEZZACHSA-N. The full InChI is InChI=1S/C10H20OSi/c1-12(2,3)10-7-5-4-6-9(10)8-11/h5,7,9-11H,4,6,8H2,1-3H3/t9-,10-/m1/s1.
What are the key properties of [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol?
[(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol has a molecular weight of 184.35 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-trimethylsilylcyclohex-3-en-1-yl]methanol is sourced from PubChem (CID 10976178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).