3-hydroxypropan-1-olate;trimethylstannanylium

C6H16O2Sn — CID 119097681

IUPAC3-hydroxypropan-1-olate;trimethylstannanylium
SMILESC[Sn+](C)C.[O-]CCCO
InChIInChI=1S/C3H7O2.3CH3.Sn/c4-2-1-3-5;;;;/h4H,1-3H2;3*1H3;/q-1;;;;+1
InChIKeyTYFUEZZHSCULDP-UHFFFAOYSA-N
MW238.90 g/mol
LogP0.10
Rot. Bonds2

About 3-hydroxypropan-1-olate;trimethylstannanylium

3-hydroxypropan-1-olate;trimethylstannanylium (PubChem CID 119097681) has the molecular formula C6H16O2Sn and a molecular weight of 238.90 g/mol. Its IUPAC name is 3-hydroxypropan-1-olate;trimethylstannanylium.

Molecular Properties

Compound Name3-hydroxypropan-1-olate;trimethylstannanylium
PubChem CID119097681
Molecular FormulaC6H16O2Sn
Molecular Weight238.90 g/mol
Exact Mass240.02
IUPAC Name3-hydroxypropan-1-olate;trimethylstannanylium
SMILESC[Sn+](C)C.[O-]CCCO
InChIInChI=1S/C3H7O2.3CH3.Sn/c4-2-1-3-5;;;;/h4H,1-3H2;3*1H3;/q-1;;;;+1
InChIKeyTYFUEZZHSCULDP-UHFFFAOYSA-N
XLogP0.10
TPSA43.29 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.90
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-hydroxyethanolate;rubidium(1+)
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tetrakis(butan-1-olate);vanadium(4+)
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hexane-1,6-diol;octane-1,8-diol
CID 21202869
pentadecane-1,15-diol
CID 518994
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Frequently Asked Questions

What is the IUPAC name of 3-hydroxypropan-1-olate;trimethylstannanylium?
The IUPAC name of 3-hydroxypropan-1-olate;trimethylstannanylium (CID 119097681) is 3-hydroxypropan-1-olate;trimethylstannanylium.
What is the SMILES notation for 3-hydroxypropan-1-olate;trimethylstannanylium?
The canonical SMILES for 3-hydroxypropan-1-olate;trimethylstannanylium is C[Sn+](C)C.[O-]CCCO.
What is the InChIKey of 3-hydroxypropan-1-olate;trimethylstannanylium?
The InChIKey is TYFUEZZHSCULDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O2.3CH3.Sn/c4-2-1-3-5;;;;/h4H,1-3H2;3*1H3;/q-1;;;;+1.
What are the key properties of 3-hydroxypropan-1-olate;trimethylstannanylium?
3-hydroxypropan-1-olate;trimethylstannanylium has a molecular weight of 238.90 g/mol, XLogP of 0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxypropan-1-olate;trimethylstannanylium is sourced from PubChem (CID 119097681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).