Research chemical
CAS Number: 68109-98-8
![Ethanaminium, 2-cyano-N-[2-[(2-cyanoethyl)amino]ethyl]-N-ethyl-N-[2-[(1-oxooctadecyl)amino]ethyl]-, ethyl sulfate (1:1) molecular structure, CAS 68109-98-8](/structure-images/68109-98-8.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
106605
Exact Mass
629.454991
InChIKey
RYYWFBAJSDFMSG-UHFFFAOYSA-N
IUPAC Name
2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(octadecanoylamino)ethyl]azanium;ethyl sulfate
SMILES String
CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNCCC#N.CCOS(=O)(=O)[O-]
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.
Ethanaminium, 2-cyano-N-[2-[(2-cyanoethyl)amino]ethyl]-N-ethyl-N-[2-[(1-oxooctadecyl)amino]ethyl]-, ethyl sulfate (1:1) is identified by CAS 68109-98-8, with molecular formula C32H63N5O5S, molecular weight 629.9, InChIKey RYYWFBAJSDFMSG-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
43
H-bond acceptors
10
H-bond donors
2
Rotatable bonds
29
Ring count
0
Aromatic rings
0
Topological polar surface area
155.14 Ų
Computed LogP
6.1
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
Ethanaminium, 2-cyano-N-[2-[(2-cyanoethyl)amino]ethyl]-N-ethyl-N-[2-[(1-oxooctadecyl)amino]ethyl]-, ethyl sulfate (1:1) (CAS 68109-98-8) is maintained as a commercial cas reference with formula C32H63N5O5S, molecular weight 629. 90 g/mol, PubChem CID 106605.
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.