Research chemical
CAS Number: 67890-05-5
Product details
For laboratory research and professional procurement workflows.
PubChem CID
171959
Exact Mass
634.267473
InChIKey
OOVMJAYMJZBIQO-UHFFFAOYSA-L
IUPAC Name
calcium bis(2-(8-methylnonyl)benzenesulfonate)
SMILES String
CC(C)CCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)CCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Ca+2]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Benzenesulfonic acid, isodecyl-, calcium salt (2:1) is identified by CAS 67890-05-5, with molecular formula C32H50CaO6S2, molecular weight 634.9, InChIKey OOVMJAYMJZBIQO-UHFFFAOYSA-L.
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.
Heavy atom count
41
H-bond acceptors
6
H-bond donors
0
Rotatable bonds
18
Ring count
2
Aromatic rings
2
Topological polar surface area
114.4 Ų
Computed LogP
7.88
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
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
Benzenesulfonic acid, isodecyl-, calcium salt (2:1) (CAS 67890-05-5) is maintained as a commercial cas reference with formula C32H50CaO6S2, molecular weight 634. 90 g/mol, PubChem CID 171959.
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.
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.