1-methoxyhexane;decakis(yttrium)

C7H14OY10-2 — CID 23636688

IUPAC1-methoxyhexane;decakis(yttrium)
SMILESCC[CH-]C[CH-]COC.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/C7H14O.10Y/c1-3-4-5-6-7-8-2;;;;;;;;;;/h4,6H,3,5,7H2,1-2H3;;;;;;;;;;/q-2;;;;;;;;;;
InChIKeySIJGQIDYDWZUBG-UHFFFAOYSA-N
MW1003.25 g/mol
LogP1.82
Rot. Bonds5

About 1-methoxyhexane;decakis(yttrium)

1-methoxyhexane;decakis(yttrium) (PubChem CID 23636688) has the molecular formula C7H14OY10-2 and a molecular weight of 1003.25 g/mol. Its IUPAC name is 1-methoxyhexane;decakis(yttrium).

Molecular Properties

Compound Name1-methoxyhexane;decakis(yttrium)
PubChem CID23636688
Molecular FormulaC7H14OY10-2
Molecular Weight1003.25 g/mol
Exact Mass1003.16
IUPAC Name1-methoxyhexane;decakis(yttrium)
SMILESCC[CH-]C[CH-]COC.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y]
InChIInChI=1S/C7H14O.10Y/c1-3-4-5-6-7-8-2;;;;;;;;;;/h4,6H,3,5,7H2,1-2H3;;;;;;;;;;/q-2;;;;;;;;;;
InChIKeySIJGQIDYDWZUBG-UHFFFAOYSA-N
XLogP1.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001003.25
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

azanide;pentane;tetrakis(yttrium)
CID 59557790
1-butoxybutane;tris(vanadium)
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hexane
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methane;methoxyethane
CID 158573885
methoxyethane;hydroiodide
CID 162009435
methoxymethylphosphanium chloride
CID 22258747
azane;methoxyethane;trihydrofluoride
CID 175134098
magnesium;1,2-dimethoxyethane;dichloride
CID 174702876
alumane;methoxyethane;hydrofluoride
CID 173390601
1,2-dimethoxyethane;nickel(2+);dichloride
CID 22904217
methoxymethane;pentane
CID 87151149
ethene;methoxyethane
CID 162163830

Frequently Asked Questions

What is the IUPAC name of 1-methoxyhexane;decakis(yttrium)?
The IUPAC name of 1-methoxyhexane;decakis(yttrium) (CID 23636688) is 1-methoxyhexane;decakis(yttrium).
What is the SMILES notation for 1-methoxyhexane;decakis(yttrium)?
The canonical SMILES for 1-methoxyhexane;decakis(yttrium) is CC[CH-]C[CH-]COC.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].
What is the InChIKey of 1-methoxyhexane;decakis(yttrium)?
The InChIKey is SIJGQIDYDWZUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O.10Y/c1-3-4-5-6-7-8-2;;;;;;;;;;/h4,6H,3,5,7H2,1-2H3;;;;;;;;;;/q-2;;;;;;;;;;.
What are the key properties of 1-methoxyhexane;decakis(yttrium)?
1-methoxyhexane;decakis(yttrium) has a molecular weight of 1003.25 g/mol, XLogP of 1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxyhexane;decakis(yttrium) is sourced from PubChem (CID 23636688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).