Research chemical
CAS Number: 105995-50-4
Product details
For laboratory research and professional procurement workflows.
PubChem CID
13338668
Exact Mass
500.055366
InChIKey
WAFDWKYNSTVECG-UHFFFAOYSA-L
IUPAC Name
magnesium bis(3-[(4-nitrophenyl)methoxy]-3-oxopropanoate)
SMILES String
C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].[Mg+2]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
(T-4)-Bis(mono((4-nitrophenyl)methyl) propanedioato-kappaO3,kappaO'1)magnesium is identified by CAS 105995-50-4, with molecular formula C20H16MgN2O12, molecular weight 500.7, InChIKey WAFDWKYNSTVECG-UHFFFAOYSA-L.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
35
H-bond acceptors
14
H-bond donors
0
Rotatable bonds
10
Ring count
2
Aromatic rings
2
Topological polar surface area
219.14 Ų
Computed LogP
-0.82
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
(T-4)-Bis(mono((4-nitrophenyl)methyl) propanedioato-kappaO3,kappaO'1)magnesium (CAS 105995-50-4) is listed in the Catalysts and Ligands portfolio, with molecular formula C20H16MgN2O12 and molecular weight 500. 70 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for catalysis development, ligand screening, and synthetic method research; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
SDS signal word: Warning; hazard codes: H302, H315, H319, H335; For research use only.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS RequestPurity and pack size confirmation: By request
Availability and lead time review: Confirmed by RFQ
Shipment documentation review: By request
For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference