hexyl-hydroxy-di(propan-2-yl)silane

C12H28OSi — CID 19956474

IUPAChexyl-hydroxy-di(propan-2-yl)silane
SMILESCCCCCC[Si](O)(C(C)C)C(C)C
InChIInChI=1S/C12H28OSi/c1-6-7-8-9-10-14(13,11(2)3)12(4)5/h11-13H,6-10H2,1-5H3
InChIKeyMIXCKKHYRAOUFJ-UHFFFAOYSA-N
MW216.44 g/mol
LogP4.32
Rot. Bonds7

About hexyl-hydroxy-di(propan-2-yl)silane

hexyl-hydroxy-di(propan-2-yl)silane (PubChem CID 19956474) has the molecular formula C12H28OSi and a molecular weight of 216.44 g/mol. Its IUPAC name is hexyl-hydroxy-di(propan-2-yl)silane.

Molecular Properties

Compound Namehexyl-hydroxy-di(propan-2-yl)silane
PubChem CID19956474
Molecular FormulaC12H28OSi
Molecular Weight216.44 g/mol
Exact Mass216.19
IUPAC Namehexyl-hydroxy-di(propan-2-yl)silane
SMILESCCCCCC[Si](O)(C(C)C)C(C)C
InChIInChI=1S/C12H28OSi/c1-6-7-8-9-10-14(13,11(2)3)12(4)5/h11-13H,6-10H2,1-5H3
InChIKeyMIXCKKHYRAOUFJ-UHFFFAOYSA-N
XLogP4.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hexyl-hydroxy-di(propan-2-yl)silane?
The IUPAC name of hexyl-hydroxy-di(propan-2-yl)silane (CID 19956474) is hexyl-hydroxy-di(propan-2-yl)silane.
What is the SMILES notation for hexyl-hydroxy-di(propan-2-yl)silane?
The canonical SMILES for hexyl-hydroxy-di(propan-2-yl)silane is CCCCCC[Si](O)(C(C)C)C(C)C.
What is the InChIKey of hexyl-hydroxy-di(propan-2-yl)silane?
The InChIKey is MIXCKKHYRAOUFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28OSi/c1-6-7-8-9-10-14(13,11(2)3)12(4)5/h11-13H,6-10H2,1-5H3.
What are the key properties of hexyl-hydroxy-di(propan-2-yl)silane?
hexyl-hydroxy-di(propan-2-yl)silane has a molecular weight of 216.44 g/mol, XLogP of 4.32, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl-hydroxy-di(propan-2-yl)silane is sourced from PubChem (CID 19956474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).