dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane

C10H14F10O2Sn — CID 87371549

IUPACdimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane
SMILESCO[Sn](OC)(C(F)(F)CCC(F)(F)F)C(F)(F)CCC(F)(F)F
InChIInChI=1S/2C4H4F5.2CH3O.Sn/c2*5-3(6)1-2-4(7,8)9;2*1-2;/h2*1-2H2;2*1H3;/q;;2*-1;+2
InChIKeyXQVAEJCUSLFBCS-UHFFFAOYSA-N
MW474.91 g/mol
LogP4.76
Rot. Bonds8

About dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane

dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane (PubChem CID 87371549) has the molecular formula C10H14F10O2Sn and a molecular weight of 474.91 g/mol. Its IUPAC name is dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane.

Molecular Properties

Compound Namedimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane
PubChem CID87371549
Molecular FormulaC10H14F10O2Sn
Molecular Weight474.91 g/mol
Exact Mass475.99
IUPAC Namedimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane
SMILESCO[Sn](OC)(C(F)(F)CCC(F)(F)F)C(F)(F)CCC(F)(F)F
InChIInChI=1S/2C4H4F5.2CH3O.Sn/c2*5-3(6)1-2-4(7,8)9;2*1-2;/h2*1-2H2;2*1H3;/q;;2*-1;+2
InChIKeyXQVAEJCUSLFBCS-UHFFFAOYSA-N
XLogP4.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.91
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane?
The IUPAC name of dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane (CID 87371549) is dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane.
What is the SMILES notation for dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane?
The canonical SMILES for dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane is CO[Sn](OC)(C(F)(F)CCC(F)(F)F)C(F)(F)CCC(F)(F)F.
What is the InChIKey of dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane?
The InChIKey is XQVAEJCUSLFBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H4F5.2CH3O.Sn/c2*5-3(6)1-2-4(7,8)9;2*1-2;/h2*1-2H2;2*1H3;/q;;2*-1;+2.
What are the key properties of dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane?
dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane has a molecular weight of 474.91 g/mol, XLogP of 4.76, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-bis(1,1,4,4,4-pentafluorobutyl)stannane is sourced from PubChem (CID 87371549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).