6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol

C13H24OSi — CID 162411525

IUPAC6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol
SMILESCC1(C)CCC=CC1(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-12(2)8-6-7-9-13(12,14)10-11-15(3,4)5/h7,9-11,14H,6,8H2,1-5H3/b11-10+
InChIKeyYABWIMKTGDPBSI-ZHACJKMWSA-N
MW224.42 g/mol
LogP3.53
Rot. Bonds2

About 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol

6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol (PubChem CID 162411525) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol.

Molecular Properties

Compound Name6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol
PubChem CID162411525
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol
SMILESCC1(C)CCC=CC1(O)/C=C/[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-12(2)8-6-7-9-13(12,14)10-11-15(3,4)5/h7,9-11,14H,6,8H2,1-5H3/b11-10+
InChIKeyYABWIMKTGDPBSI-ZHACJKMWSA-N
XLogP3.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 53.53
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 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol?
The IUPAC name of 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol (CID 162411525) is 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol.
What is the SMILES notation for 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol?
The canonical SMILES for 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol is CC1(C)CCC=CC1(O)/C=C/[Si](C)(C)C.
What is the InChIKey of 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol?
The InChIKey is YABWIMKTGDPBSI-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H24OSi/c1-12(2)8-6-7-9-13(12,14)10-11-15(3,4)5/h7,9-11,14H,6,8H2,1-5H3/b11-10+.
What are the key properties of 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol?
6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol has a molecular weight of 224.42 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-1-[(E)-2-trimethylsilylethenyl]cyclohex-2-en-1-ol is sourced from PubChem (CID 162411525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).