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3-Maleimidopropionic acid

CAT: 0013-GTR19216000-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19216000-01Size:100 mg
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Description
3-Maleimidopropionic acid is a short alkyl chain linker used in the construction of PROTAC molecules for targeted protein degradation. This bifunctional reagent enables the conjugation of E3 ligase ligands to target protein binders, facilitating the development of degraders for both in vitro and in vivo proteolysis research.
CAS Number
7423-55-4
Field of Research
Pharmacology & Drug Discovery
Smiles
OC (=O) CCN1C (=O) C=CC1=O
Molecular Formula
C7H7NO4
Molecular Weight
169.13
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Maleimidopropionic acid
CAS Number7423-55-4
PubChem CID573621
IUPAC Name3-(2,5-dioxopyrrol-1-yl)propanoic acid
Molecular FormulaC7H7NO4
Molecular Weight169.13
XLogP0
Topological Polar Surface Area74.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity251
SMILES
C1=CC(=O)N(C1=O)CCC(=O)O
InChI
InChI=1S/C7H7NO4/c9-5-1-2-6(10)8(5)4-3-7(11)12/h1-2H,3-4H2,(H,11,12)
InChIKey
IUTPJBLLJJNPAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Maleimidopropionic acid
CAS: 7423-55-4
CID: 573621
Formula: C7H7NO4
MW: 169.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight169.13
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass169.03750770
Monoisotopic Mass169.03750770
Topological Polar Surface Area74.7 Ų
Heavy Atom Count12
Formal Charge0
Complexity251
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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