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Mono-Ethyl succinate

CAT: 0024-sc-228611Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-228611Size:1 g
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CAS Number
1070-34-4

Chemical Information

Monoethyl succinate

4-Ethoxy-4-oxobutanoic acid is a hemisuccinate and a fatty acid ester.

CAS Number1070-34-4
PubChem CID70610
IUPAC Name4-ethoxy-4-oxobutanoic acid
Molecular FormulaC6H10O4
Molecular Weight146.14
XLogP0.5
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count10
Formal Charge0
Complexity130
SMILES
CCOC(=O)CCC(=O)O
InChI
InChI=1S/C6H10O4/c1-2-10-6(9)4-3-5(7)8/h2-4H2,1H3,(H,7,8)
InChIKey
LOLKAJARZKDJTD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Monoethyl succinate
CAS: 1070-34-4
CID: 70610
Formula: C6H10O4
MW: 146.14
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight146.14
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass146.05790880
Monoisotopic Mass146.05790880
Topological Polar Surface Area63.6 Ų
Heavy Atom Count10
Formal Charge0
Complexity130
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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