(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol

C10H18OSi — CID 59730954

IUPAC(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol
SMILESC[C@H]1C=CC=C([Si](C)(C)C)[C@H]1O
InChIInChI=1S/C10H18OSi/c1-8-6-5-7-9(10(8)11)12(2,3)4/h5-8,10-11H,1-4H3/t8-,10-/m0/s1
InChIKeyUMCNJCRPRVUXFJ-WPRPVWTQSA-N
MW182.34 g/mol
LogP2.36
Rot. Bonds1

About (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol

(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol (PubChem CID 59730954) has the molecular formula C10H18OSi and a molecular weight of 182.34 g/mol. Its IUPAC name is (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol
PubChem CID59730954
Molecular FormulaC10H18OSi
Molecular Weight182.34 g/mol
Exact Mass182.11
IUPAC Name(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol
SMILESC[C@H]1C=CC=C([Si](C)(C)C)[C@H]1O
InChIInChI=1S/C10H18OSi/c1-8-6-5-7-9(10(8)11)12(2,3)4/h5-8,10-11H,1-4H3/t8-,10-/m0/s1
InChIKeyUMCNJCRPRVUXFJ-WPRPVWTQSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol?
The IUPAC name of (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol (CID 59730954) is (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol.
What is the SMILES notation for (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol?
The canonical SMILES for (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol is C[C@H]1C=CC=C([Si](C)(C)C)[C@H]1O.
What is the InChIKey of (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol?
The InChIKey is UMCNJCRPRVUXFJ-WPRPVWTQSA-N. The full InChI is InChI=1S/C10H18OSi/c1-8-6-5-7-9(10(8)11)12(2,3)4/h5-8,10-11H,1-4H3/t8-,10-/m0/s1.
What are the key properties of (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol?
(1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol has a molecular weight of 182.34 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,6S)-6-methyl-2-trimethylsilylcyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 59730954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).