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Monomethyl Succinate

CAT: 0572-TRC-M542595-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M542595-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
3878-55-5
Hazard Statement
No Data Available
Purity
>95% (GC)
Smiles
COC(=O)CCC(=O)O
Molecular Formula
C5H8O4
Molecular Weight
132.11
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

monoMethyl succinate

Monomethyl succinate is a dicarboxylic acid monoester that is succinic acid in which one of the carboxy groups has been converted to its methyl ester. It is a hemisuccinate and a dicarboxylic acid monoester.

CAS Number3878-55-5
PubChem CID77487
IUPAC Name4-methoxy-4-oxobutanoic acid
Molecular FormulaC5H8O4
Molecular Weight132.11
XLogP0
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity118
SMILES
COC(=O)CCC(=O)O
InChI
InChI=1S/C5H8O4/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3,(H,6,7)
InChIKey
JDRMYOQETPMYQX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of monoMethyl succinate
CAS: 3878-55-5
CID: 77487
Formula: C5H8O4
MW: 132.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight132.11
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass132.04225873
Monoisotopic Mass132.04225873
Topological Polar Surface Area63.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity118
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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