ethyl 2-ethylbutanoate;λ2-stannane

C8H18O2Sn — CID 175348208

IUPACethyl 2-ethylbutanoate;λ2-stannane
SMILESCCOC(=O)C(CC)CC.[SnH2]
InChIInChI=1S/C8H16O2.Sn.2H/c1-4-7(5-2)8(9)10-6-3;;;/h7H,4-6H2,1-3H3;;;
InChIKeyWWPMOQSCHVLYJF-UHFFFAOYSA-N
MW264.94 g/mol
LogP1.07
Rot. Bonds4

About ethyl 2-ethylbutanoate;λ2-stannane

ethyl 2-ethylbutanoate;λ2-stannane (PubChem CID 175348208) has the molecular formula C8H18O2Sn and a molecular weight of 264.94 g/mol. Its IUPAC name is ethyl 2-ethylbutanoate;λ2-stannane.

Molecular Properties

Compound Nameethyl 2-ethylbutanoate;λ2-stannane
PubChem CID175348208
Molecular FormulaC8H18O2Sn
Molecular Weight264.94 g/mol
Exact Mass266.03
IUPAC Nameethyl 2-ethylbutanoate;λ2-stannane
SMILESCCOC(=O)C(CC)CC.[SnH2]
InChIInChI=1S/C8H16O2.Sn.2H/c1-4-7(5-2)8(9)10-6-3;;;/h7H,4-6H2,1-3H3;;;
InChIKeyWWPMOQSCHVLYJF-UHFFFAOYSA-N
XLogP1.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.94
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

sodium;ethyl 2-ethylbutanoate;hydride
CID 174848178
ethyl 2-(methylaminomethyl)butanoate
CID 23272258
(1-ethoxy-1-oxopropan-2-yl) 2-ethylbutanoate
CID 88565350
carbonic acid;ethyl 2-ethylhexanoate
CID 175024500
ethyl 2-ethyldocosanoate
CID 175304380
ethene;ethyl 2-propylpentanoate
CID 160741230
cyclobutane;2-(2-ethylbutanoyloxy)ethyl 2-ethylbutanoate
CID 67882707
tetraethyl pentane-1,2,4,5-tetracarboxylate
CID 12576810
nonadecyl 2-ethylbutanoate
CID 91709791
(ethoxycarbonylamino) 2-ethylbutanoate
CID 174978279
icosyl 2-ethylbutanoate
CID 91709792
ethyl (2R)-2-ethyldocosa-4,7,10,13,16,19-hexaenoate
CID 91354101

Frequently Asked Questions

What is the IUPAC name of ethyl 2-ethylbutanoate;λ2-stannane?
The IUPAC name of ethyl 2-ethylbutanoate;λ2-stannane (CID 175348208) is ethyl 2-ethylbutanoate;λ2-stannane.
What is the SMILES notation for ethyl 2-ethylbutanoate;λ2-stannane?
The canonical SMILES for ethyl 2-ethylbutanoate;λ2-stannane is CCOC(=O)C(CC)CC.[SnH2].
What is the InChIKey of ethyl 2-ethylbutanoate;λ2-stannane?
The InChIKey is WWPMOQSCHVLYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2.Sn.2H/c1-4-7(5-2)8(9)10-6-3;;;/h7H,4-6H2,1-3H3;;;.
What are the key properties of ethyl 2-ethylbutanoate;λ2-stannane?
ethyl 2-ethylbutanoate;λ2-stannane has a molecular weight of 264.94 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-ethylbutanoate;λ2-stannane is sourced from PubChem (CID 175348208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).