Research chemical
CAS Number: 68310-10-1
![1,1'-[[[2-[Bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl)] di-(9Z)-9-octadecenoate molecular structure, CAS 68310-10-1](/structure-images/68310-10-1.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
109289
Exact Mass
820.726839
InChIKey
ZETNFZUQZMBACZ-UHFFFAOYSA-N
IUPAC Name
1-[2-[bis(2-hydroxypropyl)amino]ethyl-(2-octadec-9-enoyloxypropyl)amino]propan-2-yl octadec-9-enoate
SMILES String
CCCCCCCCC=CCCCCCCCC(=O)OC(C)CN(CCN(CC(C)O)CC(C)O)CC(C)OC(=O)CCCCCCCC=CCCCCCCCC
No physical property values available.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
1,1'-[[[2-[Bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl)] di-(9Z)-9-octadecenoate is identified by CAS 68310-10-1, with molecular formula C50H96N2O6, molecular weight 821.3, InChIKey ZETNFZUQZMBACZ-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.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
58
H-bond acceptors
8
H-bond donors
2
Rotatable bonds
43
Ring count
0
Aromatic rings
0
Topological polar surface area
99.54 Ų
Computed LogP
12.29
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
1,1'-[[[2-[Bis(2-hydroxypropyl)amino]ethyl]imino]bis(1-methyl-2,1-ethanediyl)] di-(9Z)-9-octadecenoate (CAS 68310-10-1) is maintained as a commercial cas reference with formula C50H96N2O6, molecular weight 821. 30 g/mol, PubChem CID 109289.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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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.