Research chemical
CAS Number: 70693-75-3
![Sulfuric acid, diethyl ester, compd. with N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis[octadecanamide] (1:1) molecular structure, CAS 70693-75-3](/structure-images/70693-75-3.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
116817
Exact Mass
842.689408
InChIKey
RCLIBJFBPOKHPA-UHFFFAOYSA-N
IUPAC Name
N-[2-[2-cyanoethyl-[2-(octadecanoylamino)ethyl]amino]ethyl]octadecanamide;diethyl sulfate
SMILES String
CCCCCCCCCCCCCCCCCC(=O)NCCN(CCC#N)CCNC(=O)CCCCCCCCCCCCCCCCC.CCOS(=O)(=O)OCC
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.
Sulfuric acid, diethyl ester, compd. with N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis[octadecanamide] (1:1) is identified by CAS 70693-75-3, with molecular formula C47H94N4O6S, molecular weight 843.3, InChIKey RCLIBJFBPOKHPA-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
58
H-bond acceptors
10
H-bond donors
2
Rotatable bonds
44
Ring count
0
Aromatic rings
0
Topological polar surface area
137.83 Ų
Computed LogP
12.26
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
organic nitrogen ligand candidate
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
Sulfuric acid, diethyl ester, compd. with N,N'-[[(2-cyanoethyl)imino]di-2,1-ethanediyl]bis[octadecanamide] (1:1) (CAS 70693-75-3) is maintained as a commercial cas reference with formula C47H94N4O6S, molecular weight 843. 30 g/mol, PubChem CID 116817.
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.