ethoxy-methyl-oxotin

C3H8O2Sn — CID 87371731

IUPACethoxy-methyl-oxotin
SMILESCCO[Sn](C)=O
InChIInChI=1S/C2H5O.CH3.O.Sn/c1-2-3;;;/h2H2,1H3;1H3;;/q-1;;;+1
InChIKeyYTMLRHKKWDYROM-UHFFFAOYSA-N
MW194.81 g/mol
LogP0.57
Rot. Bonds2

About ethoxy-methyl-oxotin

ethoxy-methyl-oxotin (PubChem CID 87371731) has the molecular formula C3H8O2Sn and a molecular weight of 194.81 g/mol. Its IUPAC name is ethoxy-methyl-oxotin.

Molecular Properties

Compound Nameethoxy-methyl-oxotin
PubChem CID87371731
Molecular FormulaC3H8O2Sn
Molecular Weight194.81 g/mol
Exact Mass195.95
IUPAC Nameethoxy-methyl-oxotin
SMILESCCO[Sn](C)=O
InChIInChI=1S/C2H5O.CH3.O.Sn/c1-2-3;;;/h2H2,1H3;1H3;;/q-1;;;+1
InChIKeyYTMLRHKKWDYROM-UHFFFAOYSA-N
XLogP0.57
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.81
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Tin (II) ethoxide
CID 16685059
Methylperoxyethane
CID 14795133
Magnesium ethoxide methoxide (1/1/1)
CID 18408038
Ethoxymethoxymagnesium
CID 44152531
Ethoxy(trimethyl)stannane
CID 16694568
Diethoxy(dimethyl)stannane
CID 16694581
Ethanolate;tin(2+)
CID 71317418
Ethanolate;trimethylstannanylium
CID 88818679
Dipropoxytin
CID 16704403
CID 16709237
CID 16709237
Calcium;ethanolate;methanolate
CID 18408007
Barium(2+);ethanolate;methanolate
CID 18408052

Frequently Asked Questions

What is the IUPAC name of ethoxy-methyl-oxotin?
The IUPAC name of ethoxy-methyl-oxotin (CID 87371731) is ethoxy-methyl-oxotin.
What is the SMILES notation for ethoxy-methyl-oxotin?
The canonical SMILES for ethoxy-methyl-oxotin is CCO[Sn](C)=O.
What is the InChIKey of ethoxy-methyl-oxotin?
The InChIKey is YTMLRHKKWDYROM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O.CH3.O.Sn/c1-2-3;;;/h2H2,1H3;1H3;;/q-1;;;+1.
What are the key properties of ethoxy-methyl-oxotin?
ethoxy-methyl-oxotin has a molecular weight of 194.81 g/mol, XLogP of 0.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-methyl-oxotin is sourced from PubChem (CID 87371731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).