Products for Research Use Only

Ald-Ph-NHS ester

CAT: 0013-GTR19177814-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19177814-01Size:100 mg
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Description
The Ald-Ph-NHS ester is a non-cleavable chemical linker designed for constructing stable antibody-drug conjugates (ADCs) . It is widely used in oncology research for developing targeted therapeutics, facilitating both in vitro cytotoxicity assays and in vivo efficacy studies in preclinical models.
CAS Number
60444-78-2
Product Name Alternative
Antibody-drug conjugates linkers, ADC Linkers, ADCLinker, AldPhNHS ester, Ald-Ph-NHS ester, Ald Ph NHS ester, ADC Linker, Non-cleavable, inhibit, Inhibitor
Field of Research
Pharmacology & Drug Discovery
Purity
98.28% (May vary between batches)
Smiles
O=CC1=CC=C (C=C1) C (=O) ON1C (=O) CCC1=O
Molecular Formula
C12H9NO5
Molecular Weight
247.2
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde
CAS Number60444-78-2
PubChem CID4126130
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 4-formylbenzoate
Molecular FormulaC12H9NO5
Molecular Weight247.20
XLogP0.4
Topological Polar Surface Area80.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity368
SMILES
C1CC(=O)N(C1=O)OC(=O)C2=CC=C(C=C2)C=O
InChI
InChI=1S/C12H9NO5/c14-7-8-1-3-9(4-2-8)12(17)18-13-10(15)5-6-11(13)16/h1-4,7H,5-6H2
InChIKey
VHYRHFNOWKMCHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(((2,5-Dioxopyrrolidin-1-yl)oxy)carbonyl)benzaldehyde
CAS: 60444-78-2
CID: 4126130
Formula: C12H9NO5
MW: 247.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight247.20
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass247.04807239
Monoisotopic Mass247.04807239
Topological Polar Surface Area80.8 Ų
Heavy Atom Count18
Formal Charge0
Complexity368
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