CID 59850394

C13H35O7Si6 — CID 59850394

IUPAC—
SMILESC[Si]O[Si](C)(C)O[Si@@](C)(O[Si]C)O[Si](C)O[Si](C)(C)CCCOCCO
InChIInChI=1S/C13H35O7Si6/c1-21-16-25(6,7)20-26(8,17-22-2)19-23(3)18-24(4,5)13-9-11-15-12-10-14/h14H,9-13H2,1-8H3/t26-/m0/s1
InChIKeyWJAJHNNBFBAOHQ-SANMLTNESA-N
MW471.93 g/mol
LogP2.40
Rot. Bonds16

About CID 59850394

CID 59850394 (PubChem CID 59850394) has the molecular formula C13H35O7Si6 and a molecular weight of 471.93 g/mol.

Molecular Properties

Compound NameCID 59850394
PubChem CID59850394
Molecular FormulaC13H35O7Si6
Molecular Weight471.93 g/mol
Exact Mass471.10
IUPAC Name—
SMILESC[Si]O[Si](C)(C)O[Si@@](C)(O[Si]C)O[Si](C)O[Si](C)(C)CCCOCCO
InChIInChI=1S/C13H35O7Si6/c1-21-16-25(6,7)20-26(8,17-22-2)19-23(3)18-24(4,5)13-9-11-15-12-10-14/h14H,9-13H2,1-8H3/t26-/m0/s1
InChIKeyWJAJHNNBFBAOHQ-SANMLTNESA-N
XLogP2.40
TPSA75.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.93
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxy]ethanol
CID 20801390
CID 123762580
CID 123762580
2-[3-[[[bis[3-(2-hydroxyethoxy)propyl]-methylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethanol
CID 59180551
2-[3-[[3-ethenoxypropyl(dimethyl)silyl]oxy-dimethylsilyl]propoxy]ethanol;hydrate
CID 165045281
2-[3-[[[[dimethyl(methylsilyloxy)silyl]oxy-methyl-methylsilyloxysilyl]oxy-methylsilyl]oxy-dimethylsilyl]propoxy]ethanol
CID 123943383
2-[3-[[[3-(methoxymethoxy)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethanol
CID 58159183
2-[3-[dihydroxy(methyl)silyl]propoxy]ethanol
CID 146831861
2-[3-[[[[3-(2-hydroxyethoxy)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methyl-methylsilyloxysilyl]oxymethoxy-dimethylsilyl]propoxy]ethanol
CID 157187405
CID 58050979
CID 58050979
2-[3-[[1-ethenoxypropyl(dimethyl)silyl]oxy-dimethylsilyl]propoxy]ethanol;methane;hydrate
CID 158143243
CID 58059369
CID 58059369
2-(15-trimethylsilylpentadecoxy)ethanol
CID 170689159

Frequently Asked Questions

What is the IUPAC name of CID 59850394?
The IUPAC name of CID 59850394 (CID 59850394) is not available.
What is the SMILES notation for CID 59850394?
The canonical SMILES for CID 59850394 is C[Si]O[Si](C)(C)O[Si@@](C)(O[Si]C)O[Si](C)O[Si](C)(C)CCCOCCO.
What is the InChIKey of CID 59850394?
The InChIKey is WJAJHNNBFBAOHQ-SANMLTNESA-N. The full InChI is InChI=1S/C13H35O7Si6/c1-21-16-25(6,7)20-26(8,17-22-2)19-23(3)18-24(4,5)13-9-11-15-12-10-14/h14H,9-13H2,1-8H3/t26-/m0/s1.
What are the key properties of CID 59850394?
CID 59850394 has a molecular weight of 471.93 g/mol, XLogP of 2.40, 16 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59850394 is sourced from PubChem (CID 59850394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).