2-ethoxypropane;zinc

C5H12OZn — CID 174321747

IUPAC2-ethoxypropane;zinc
SMILESCCOC(C)C.[Zn]
InChIInChI=1S/C5H12O.Zn/c1-4-6-5(2)3;/h5H,4H2,1-3H3;
InChIKeyLWAHLWGUXLAVNJ-UHFFFAOYSA-N
MW153.54 g/mol
LogP1.43
Rot. Bonds2

About 2-ethoxypropane;zinc

2-ethoxypropane;zinc (PubChem CID 174321747) has the molecular formula C5H12OZn and a molecular weight of 153.54 g/mol. Its IUPAC name is 2-ethoxypropane;zinc.

Molecular Properties

Compound Name2-ethoxypropane;zinc
PubChem CID174321747
Molecular FormulaC5H12OZn
Molecular Weight153.54 g/mol
Exact Mass152.02
IUPAC Name2-ethoxypropane;zinc
SMILESCCOC(C)C.[Zn]
InChIInChI=1S/C5H12O.Zn/c1-4-6-5(2)3;/h5H,4H2,1-3H3;
InChIKeyLWAHLWGUXLAVNJ-UHFFFAOYSA-N
XLogP1.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.54
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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2-ethoxypropane;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
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CID 159597367
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Frequently Asked Questions

What is the IUPAC name of 2-ethoxypropane;zinc?
The IUPAC name of 2-ethoxypropane;zinc (CID 174321747) is 2-ethoxypropane;zinc.
What is the SMILES notation for 2-ethoxypropane;zinc?
The canonical SMILES for 2-ethoxypropane;zinc is CCOC(C)C.[Zn].
What is the InChIKey of 2-ethoxypropane;zinc?
The InChIKey is LWAHLWGUXLAVNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.Zn/c1-4-6-5(2)3;/h5H,4H2,1-3H3;.
What are the key properties of 2-ethoxypropane;zinc?
2-ethoxypropane;zinc has a molecular weight of 153.54 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxypropane;zinc is sourced from PubChem (CID 174321747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).