(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol

C11H24O2Si — CID 88943244

IUPAC(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol
SMILESC=C[C@@H](CCO)CC(C)(C)[Si](C)(C)O
InChIInChI=1S/C11H24O2Si/c1-6-10(7-8-12)9-11(2,3)14(4,5)13/h6,10,12-13H,1,7-9H2,2-5H3/t10-/m0/s1
InChIKeyWLIKSZACONWJCD-JTQLQIEISA-N
MW216.40 g/mol
LogP2.54
Rot. Bonds6

About (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol

(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol (PubChem CID 88943244) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol.

Molecular Properties

Compound Name(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol
PubChem CID88943244
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Name(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol
SMILESC=C[C@@H](CCO)CC(C)(C)[Si](C)(C)O
InChIInChI=1S/C11H24O2Si/c1-6-10(7-8-12)9-11(2,3)14(4,5)13/h6,10,12-13H,1,7-9H2,2-5H3/t10-/m0/s1
InChIKeyWLIKSZACONWJCD-JTQLQIEISA-N
XLogP2.54
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol?
The IUPAC name of (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol (CID 88943244) is (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol.
What is the SMILES notation for (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol?
The canonical SMILES for (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol is C=C[C@@H](CCO)CC(C)(C)[Si](C)(C)O.
What is the InChIKey of (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol?
The InChIKey is WLIKSZACONWJCD-JTQLQIEISA-N. The full InChI is InChI=1S/C11H24O2Si/c1-6-10(7-8-12)9-11(2,3)14(4,5)13/h6,10,12-13H,1,7-9H2,2-5H3/t10-/m0/s1.
What are the key properties of (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol?
(3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol has a molecular weight of 216.40 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-ethenyl-5-[hydroxy(dimethyl)silyl]-5-methylhexan-1-ol is sourced from PubChem (CID 88943244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).