(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol

C10H22OSi — CID 10081148

IUPAC(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol
SMILESC/C=C(\C)[C@H](CCO)[Si](C)(C)C
InChIInChI=1S/C10H22OSi/c1-6-9(2)10(7-8-11)12(3,4)5/h6,10-11H,7-8H2,1-5H3/b9-6+/t10-/m0/s1
InChIKeyXIQZCJQEQZKWMF-ZKXNXJMVSA-N
MW186.37 g/mol
LogP3.04
Rot. Bonds4

About (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol

(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol (PubChem CID 10081148) has the molecular formula C10H22OSi and a molecular weight of 186.37 g/mol. Its IUPAC name is (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol.

Molecular Properties

Compound Name(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol
PubChem CID10081148
Molecular FormulaC10H22OSi
Molecular Weight186.37 g/mol
Exact Mass186.14
IUPAC Name(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol
SMILESC/C=C(\C)[C@H](CCO)[Si](C)(C)C
InChIInChI=1S/C10H22OSi/c1-6-9(2)10(7-8-11)12(3,4)5/h6,10-11H,7-8H2,1-5H3/b9-6+/t10-/m0/s1
InChIKeyXIQZCJQEQZKWMF-ZKXNXJMVSA-N
XLogP3.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.37
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'}

Analyze (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol?
The IUPAC name of (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol (CID 10081148) is (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol.
What is the SMILES notation for (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol?
The canonical SMILES for (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol is C/C=C(\C)[C@H](CCO)[Si](C)(C)C.
What is the InChIKey of (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol?
The InChIKey is XIQZCJQEQZKWMF-ZKXNXJMVSA-N. The full InChI is InChI=1S/C10H22OSi/c1-6-9(2)10(7-8-11)12(3,4)5/h6,10-11H,7-8H2,1-5H3/b9-6+/t10-/m0/s1.
What are the key properties of (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol?
(E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol has a molecular weight of 186.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,3S)-4-methyl-3-trimethylsilylhex-4-en-1-ol is sourced from PubChem (CID 10081148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).