2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol

C14H28OSi — CID 59946438

IUPAC2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol
SMILESCC1=C(C)C(O)(C[Si](C)(C)C)C(C)(C)CC1
InChIInChI=1S/C14H28OSi/c1-11-8-9-13(3,4)14(15,12(11)2)10-16(5,6)7/h15H,8-10H2,1-7H3
InChIKeyIRGWUXGNALOXID-UHFFFAOYSA-N
MW240.46 g/mol
LogP4.21
Rot. Bonds2

About 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol

2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol (PubChem CID 59946438) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol
PubChem CID59946438
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Name2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol
SMILESCC1=C(C)C(O)(C[Si](C)(C)C)C(C)(C)CC1
InChIInChI=1S/C14H28OSi/c1-11-8-9-13(3,4)14(15,12(11)2)10-16(5,6)7/h15H,8-10H2,1-7H3
InChIKeyIRGWUXGNALOXID-UHFFFAOYSA-N
XLogP4.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 54.21
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 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol?
The IUPAC name of 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol (CID 59946438) is 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol.
What is the SMILES notation for 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol?
The canonical SMILES for 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol is CC1=C(C)C(O)(C[Si](C)(C)C)C(C)(C)CC1.
What is the InChIKey of 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol?
The InChIKey is IRGWUXGNALOXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28OSi/c1-11-8-9-13(3,4)14(15,12(11)2)10-16(5,6)7/h15H,8-10H2,1-7H3.
What are the key properties of 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol?
2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol has a molecular weight of 240.46 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,6,6-tetramethyl-1-(trimethylsilylmethyl)cyclohex-2-en-1-ol is sourced from PubChem (CID 59946438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).