Research chemical
CAS Number: 52455-30-8
![Chromate(1-), triaqua[3-(hydroxy-kappaO)-4-[2-[2-(hydroxy-kappaO)-1-naphthalenyl]diazenyl-kappaN1]-7-nitro-1-naphthalenesulfonato(3-)]-, sodium (1:1) molecular structure, CAS 52455-30-8](/structure-images/52455-30-8.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
104198
Exact Mass
564.985914
InChIKey
AMNUWPJNRKWMFK-UHFFFAOYSA-K
IUPAC Name
sodium;chromium(2+);7-nitro-3-oxido-4-[(2-oxidonaphthalen-1-yl)diazenyl]naphthalene-1-sulfonate;trihydrate
SMILES String
C1=CC=C2C(=C1)C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3[O-])S(=O)(=O)[O-])[N+](=O)[O-])[O-].O.O.O.[Na+].[Cr+2]
No physical property values available.
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.
Chromate(1-), triaqua[3-(hydroxy-kappaO)-4-[2-[2-(hydroxy-kappaO)-1-naphthalenyl]diazenyl-kappaN1]-7-nitro-1-naphthalenesulfonato(3-)]-, sodium (1:1) is identified by CAS 52455-30-8, with molecular formula C20H16CrN3NaO10S, molecular weight 565.4, InChIKey AMNUWPJNRKWMFK-UHFFFAOYSA-K.
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.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
36
H-bond acceptors
13
H-bond donors
6
Rotatable bonds
4
Ring count
4
Aromatic rings
4
Topological polar surface area
265.68 Ų
Computed LogP
-2.1
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
transition metal catalyst or complex
Precious metal motif
No
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.
Structural features
40 g/mol, PubChem CID 104198.
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 nitrogen-containing heterocycle, transition-metal-containing structure.
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.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.