Research chemical
CAS Number: 68155-78-2
Product details
For laboratory research and professional procurement workflows.
PubChem CID
15361742
Exact Mass
726.894462
InChIKey
OIPXXWBYRWQVLJ-UHFFFAOYSA-G
IUPAC Name
heptasodium;[bis[2-[[hydroxy(oxido)phosphoryl]methyl-(phosphonatomethyl)amino]ethyl]amino]methyl-hydroxyphosphinate
SMILES String
O=P([O-])([O-])CN(CCN(CCN(CP(=O)([O-])[O-])CP(=O)([O-])O)CP(=O)([O-])O)CP(=O)([O-])O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
No physical property values available.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Heptasodium diethylenetriaminepentamethylenephosphonate is identified by CAS 68155-78-2, with molecular formula C9H21N3Na7O15P5, molecular weight 727.07, InChIKey OIPXXWBYRWQVLJ-UHFFFAOYSA-G.
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.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
39
H-bond acceptors
18
H-bond donors
3
Rotatable bonds
16
Ring count
0
Aromatic rings
0
Topological polar surface area
317.18 Ų
Computed LogP
-27.83
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
phosphine ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
Yes
N-heterocycle motif
No
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
Heptasodium diethylenetriaminepentamethylenephosphonate (CAS 68155-78-2) is maintained as a commercial cas reference with formula C9H21N3Na7O15P5, molecular weight 727. 07 g/mol, PubChem CID 15361742.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include phosphine-ligand motif.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.