methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin

C6H13F3O3Sn2 — CID 174486985

IUPACmethoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin
SMILESCO[Sn]O[SnH](CCCC(F)(F)F)OC
InChIInChI=1S/C4H6F3.2CH3O.O.2Sn.H/c1-2-3-4(5,6)7;2*1-2;;;;/h1-3H2;2*1H3;;;;/q;2*-1;;2*+1;
InChIKeyKAWWZOCQOUIXAL-UHFFFAOYSA-N
MW427.58 g/mol
LogP1.39
Rot. Bonds7

About methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin

methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin (PubChem CID 174486985) has the molecular formula C6H13F3O3Sn2 and a molecular weight of 427.58 g/mol. Its IUPAC name is methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin.

Molecular Properties

Compound Namemethoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin
PubChem CID174486985
Molecular FormulaC6H13F3O3Sn2
Molecular Weight427.58 g/mol
Exact Mass429.89
IUPAC Namemethoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin
SMILESCO[Sn]O[SnH](CCCC(F)(F)F)OC
InChIInChI=1S/C4H6F3.2CH3O.O.2Sn.H/c1-2-3-4(5,6)7;2*1-2;;;;/h1-3H2;2*1H3;;;;/q;2*-1;;2*+1;
InChIKeyKAWWZOCQOUIXAL-UHFFFAOYSA-N
XLogP1.39
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.58
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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3,3-dimethyl-N-(5,5,5-trifluoropentyl)butan-1-amine
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1,1,1,6,6,6-hexafluoro-2-methylhexan-2-ol
CID 116535920
hydroxy-dimethyl-(4,4,4-trifluorobutyl)silane
CID 140692013
1-methoxy-3-(6,6,6-trifluorohexan-2-ylamino)propan-2-ol
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Frequently Asked Questions

What is the IUPAC name of methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin?
The IUPAC name of methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin (CID 174486985) is methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin.
What is the SMILES notation for methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin?
The canonical SMILES for methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin is CO[Sn]O[SnH](CCCC(F)(F)F)OC.
What is the InChIKey of methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin?
The InChIKey is KAWWZOCQOUIXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F3.2CH3O.O.2Sn.H/c1-2-3-4(5,6)7;2*1-2;;;;/h1-3H2;2*1H3;;;;/q;2*-1;;2*+1;.
What are the key properties of methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin?
methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin has a molecular weight of 427.58 g/mol, XLogP of 1.39, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-[methoxy(4,4,4-trifluorobutyl)stannyl]oxytin is sourced from PubChem (CID 174486985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).