Research chemical
Sodium triethanolamine tris(dihydrogen phosphate)
CAS Number: 66197-79-3
Product details
Identity & specification
- Molecular formula
- C6H15NNa3O12P3
- Molecular weight
- 455.07 g/mol
- Product type
- Research-use catalog compound
- Documentation
- COA / SDS available by request
For laboratory research and professional procurement workflows.
Technical identifiers
Show PubChem, InChIKey, IUPAC, and SMILES
PubChem CID
171768
Exact Mass
454.950019
InChIKey
MWIBOTNHGPNIQL-UHFFFAOYSA-K
IUPAC Name
trisodium;2-[bis[2-[hydroxy(oxido)phosphoryl]oxyethyl]amino]ethyl hydrogen phosphate
SMILES String
C(COP(=O)(O)[O-])N(CCOP(=O)(O)[O-])CCOP(=O)(O)[O-].[Na+].[Na+].[Na+]
Physical Properties
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Computed Structure Descriptors
Show calculated structure fields
Heavy atom count
25
H-bond acceptors
13
H-bond donors
3
Rotatable bonds
12
Ring count
0
Aromatic rings
0
Topological polar surface area
212.01 Ų
Computed LogP
-12.27
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.
Catalog Facts
Structural features
Sodium triethanolamine tris(dihydrogen phosphate) (CAS 66197-79-3) is maintained as a commercial cas reference with formula C6H15NNa3O12P3, molecular weight 455. 07 g/mol, PubChem CID 171768.
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.
Applications & Classification
Safety & Handling
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Catalog navigation
Related Catalog Entries
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Procurement questions
What are the key identifiers for Sodium triethanolamine tris(dihydrogen phosphate) (CAS 66197-79-3)?
Sodium triethanolamine tris(dihydrogen phosphate) is identified by CAS 66197-79-3, with molecular formula C6H15NNa3O12P3, molecular weight 455.07, InChIKey MWIBOTNHGPNIQL-UHFFFAOYSA-K.
Can I request a COA for CAS 66197-79-3?
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Can I request supplier SDS for Sodium triethanolamine tris(dihydrogen phosphate)?
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Is CAS 66197-79-3 available for quotation?
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Can MolGraph support bulk sourcing or custom synthesis review?
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.