methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin

C5H7F5O2Sn — CID 87373132

IUPACmethoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin
SMILESCO[Sn](=O)C(F)(F)CCC(F)(F)F
InChIInChI=1S/C4H4F5.CH3O.O.Sn/c5-3(6)1-2-4(7,8)9;1-2;;/h1-2H2;1H3;;/q;-1;;+1
InChIKeyNDUGELRSKOGPHV-UHFFFAOYSA-N
MW312.81 g/mol
LogP2.07
Rot. Bonds4

About methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin

methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin (PubChem CID 87373132) has the molecular formula C5H7F5O2Sn and a molecular weight of 312.81 g/mol. Its IUPAC name is methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin.

Molecular Properties

Compound Namemethoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin
PubChem CID87373132
Molecular FormulaC5H7F5O2Sn
Molecular Weight312.81 g/mol
Exact Mass313.94
IUPAC Namemethoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin
SMILESCO[Sn](=O)C(F)(F)CCC(F)(F)F
InChIInChI=1S/C4H4F5.CH3O.O.Sn/c5-3(6)1-2-4(7,8)9;1-2;;/h1-2H2;1H3;;/q;-1;;+1
InChIKeyNDUGELRSKOGPHV-UHFFFAOYSA-N
XLogP2.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.81
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

decoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin
CID 87370856
methoxy(3,3,3-trifluoropropyl)silane
CID 123372538
benzene;ethoxy-oxo-(4,4,4-trifluorobutyl)tin
CID 175260809
5,5,5-trifluoro-2-trimethoxysilylpentane-2-thiol
CID 87125331
ethoxy-(1,1,2,2,4,4,4-heptafluorobutyl)-oxotin
CID 87372541
methoxy(1,1,2,2,3,3,6,6,6-nonafluorohexyl)silane
CID 173374467
1,1,1-trifluorooctane;trimethoxysilane
CID 175508235
1,1,1-trifluoro-4-iodo-4-methylpentane
CID 162614405
5,5,5-trifluoro-N-(methoxymethyl)pentanamide
CID 87257308
methoxy-methyl-(3,3,3-trifluoropropyl)silane
CID 123944357
3-dichlorophosphoryloxy-1,1,1-trifluoropropane
CID 58544432
5,5,5-trifluoro-1,1-dimethoxypentan-2-one
CID 79493425

Frequently Asked Questions

What is the IUPAC name of methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin?
The IUPAC name of methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin (CID 87373132) is methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin.
What is the SMILES notation for methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin?
The canonical SMILES for methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin is CO[Sn](=O)C(F)(F)CCC(F)(F)F.
What is the InChIKey of methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin?
The InChIKey is NDUGELRSKOGPHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F5.CH3O.O.Sn/c5-3(6)1-2-4(7,8)9;1-2;;/h1-2H2;1H3;;/q;-1;;+1.
What are the key properties of methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin?
methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin has a molecular weight of 312.81 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-oxo-(1,1,4,4,4-pentafluorobutyl)tin is sourced from PubChem (CID 87373132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).