Research chemical
CAS Number: 125899-91-4
![Octadecyl 3-[[3-(dodecyloxy)-3-oxopropyl]thio]propionate molecular structure, CAS 125899-91-4](/structure-images/125899-91-4.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
83140
Exact Mass
598.499482
InChIKey
RRZCFXQTVDJDGF-UHFFFAOYSA-N
IUPAC Name
dodecyl 3-(3-octadecoxy-3-oxopropyl)sulfanylpropanoate
SMILES String
CCCCCCCCCCCCCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
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.
Octadecyl 3-[[3-(dodecyloxy)-3-oxopropyl]thio]propionate is identified by CAS 125899-91-4, with molecular formula C36H70O4S, molecular weight 599, InChIKey RRZCFXQTVDJDGF-UHFFFAOYSA-N.
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
4
H-bond donors
0
Rotatable bonds
34
Ring count
0
Aromatic rings
0
Topological polar surface area
52.6 Ų
Computed LogP
11.77
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
Octadecyl 3-[[3-(dodecyloxy)-3-oxopropyl]thio]propionate (CAS 125899-91-4) is maintained as a commercial cas reference with formula C36H70O4S, molecular weight 599. 00 g/mol, PubChem CID 83140.
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.