6-trimethylsilyloxyhexane-1,1,1,2,2-pentol

C9H22O6Si — CID 54062512

IUPAC6-trimethylsilyloxyhexane-1,1,1,2,2-pentol
SMILESC[Si](C)(C)OCCCCC(O)(O)C(O)(O)O
InChIInChI=1S/C9H22O6Si/c1-16(2,3)15-7-5-4-6-8(10,11)9(12,13)14/h10-14H,4-7H2,1-3H3
InChIKeyMASODMMUZTUFPI-UHFFFAOYSA-N
MW254.35 g/mol
LogP-0.68
Rot. Bonds7

About 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol

6-trimethylsilyloxyhexane-1,1,1,2,2-pentol (PubChem CID 54062512) has the molecular formula C9H22O6Si and a molecular weight of 254.35 g/mol. Its IUPAC name is 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol.

Molecular Properties

Compound Name6-trimethylsilyloxyhexane-1,1,1,2,2-pentol
PubChem CID54062512
Molecular FormulaC9H22O6Si
Molecular Weight254.35 g/mol
Exact Mass254.12
IUPAC Name6-trimethylsilyloxyhexane-1,1,1,2,2-pentol
SMILESC[Si](C)(C)OCCCCC(O)(O)C(O)(O)O
InChIInChI=1S/C9H22O6Si/c1-16(2,3)15-7-5-4-6-8(10,11)9(12,13)14/h10-14H,4-7H2,1-3H3
InChIKeyMASODMMUZTUFPI-UHFFFAOYSA-N
XLogP-0.68
TPSA110.38 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 5-0.68
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol?
The IUPAC name of 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol (CID 54062512) is 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol.
What is the SMILES notation for 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol?
The canonical SMILES for 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol is C[Si](C)(C)OCCCCC(O)(O)C(O)(O)O.
What is the InChIKey of 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol?
The InChIKey is MASODMMUZTUFPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O6Si/c1-16(2,3)15-7-5-4-6-8(10,11)9(12,13)14/h10-14H,4-7H2,1-3H3.
What are the key properties of 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol?
6-trimethylsilyloxyhexane-1,1,1,2,2-pentol has a molecular weight of 254.35 g/mol, XLogP of -0.68, 7 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-trimethylsilyloxyhexane-1,1,1,2,2-pentol is sourced from PubChem (CID 54062512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).