Research chemical
fac-Tris(2-phenylpyridine)iridium , fac-Ir(ppy)3
CAS Number: 94928-86-6
Product details
Identity & specification
- Molecular formula
- C33H24IrN3
- Molecular weight
- 654.78 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
11388194
Exact Mass
655.15994
InChIKey
NSABRUJKERBGOU-UHFFFAOYSA-N
IUPAC Name
iridium(3+);tris(2-phenylpyridine)
SMILES String
C=1C=C[C-]2=C(C1)C=3C=CC=C[N]3[Ir+3]245([C-]=6C=CC=CC6C=7C=CC=C[N]74)[C-]=8C=CC=CC8C=9C=CC=C[N]95
Physical Properties
Appearance
Pale yellow to Light yellow Powder
Physical State
powder
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
37
H-bond acceptors
3
H-bond donors
0
Rotatable bonds
3
Ring count
6
Aromatic rings
6
Topological polar surface area
17.7 Ų
Computed LogP
7.64
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
precious metal catalyst or complex
Precious metal motif
Yes
Transition metal motif
Yes
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.
Catalog Facts
Structural features
Research Catalog Compound - Request Quote and Documentation (CAS 94928-86-6) is listed for precious-metal catalyst sourcing and screening.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Typical research procurement context: platinum-group or noble-metal research workflows, with buyer review before selection.
Documentation needs
Preliminary handling notes only; confirm supplier SDS before handling. Review storage, transport, and documentation requirements internally before order acceptance.
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.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS RequestProcurement questions
What are the key identifiers for fac-Tris(2-phenylpyridine)iridium , fac-Ir(ppy)3 (CAS 94928-86-6)?
fac-Tris(2-phenylpyridine)iridium , fac-Ir(ppy)3 is identified by CAS 94928-86-6, with molecular formula C33H24IrN3, molecular weight 654.78, InChIKey NSABRUJKERBGOU-UHFFFAOYSA-N.
Can I request a COA for CAS 94928-86-6?
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Can I request supplier SDS for fac-Tris(2-phenylpyridine)iridium , fac-Ir(ppy)3?
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Is CAS 94928-86-6 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.