Research chemical
CAS Number: 105462-25-7
Product details
For laboratory research and professional procurement workflows.
PubChem CID
406400
Exact Mass
283.001076
InChIKey
ZWHKKFUMEGWCKH-UHFFFAOYSA-N
IUPAC Name
(1-hydroxy-1-phosphono-2-pyridin-4-ylethyl)phosphonic acid
SMILES String
C1=CN=CC=C1CC(O)(P(=O)(O)O)P(=O)(O)O
Appearance
Catalog navigation
Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.
NE-58043 is identified by CAS 105462-25-7, with molecular formula C7H11NO7P2, molecular weight 283.11, InChIKey ZWHKKFUMEGWCKH-UHFFFAOYSA-N.
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.
Powder or crystals
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
17
H-bond acceptors
8
H-bond donors
5
Rotatable bonds
4
Ring count
1
Aromatic rings
1
Topological polar surface area
148.18 Ų
Computed LogP
-0.37
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
phosphine ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
Yes
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
NE-58043 (CAS 105462-25-7) is maintained as a cataloged research chemical with formula C7H11NO7P2, molecular weight 283. 11 g/mol, PubChem CID 406400.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for identity verification, supplier-aware sourcing review, and RFQ preparation; structure-derived tags include nitrogen-containing heterocycle, phosphine-ligand motif, drug-like rule profile.
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 Request