Research chemical
CAS Number: 8013-07-8
Product details
For laboratory research and professional procurement workflows.
PubChem CID
71306824
Exact Mass
974.705829
InChIKey
JJGBFZZXKPWGCW-UHFFFAOYSA-N
IUPAC Name
2,3-bis[8-[3-[(3-pentyloxiran-2-yl)methyl]oxiran-2-yl]octanoyloxy]propyl 8-[3-[(3-pentyloxiran-2-yl)methyl]oxiran-2-yl]octanoate
SMILES String
CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC1OC1CC1OC1CCCCC)OC(=O)CCCCCCCC1OC1CC1OC1CCCCC
No physical property values available.
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.
1,1',1''-(1,2,3-Propanetriyl) tris(3-((3-pentyl-2-oxiranyl)methyl)-2-oxiraneoctanoate) is identified by CAS 8013-07-8, with molecular formula C57H98O12, molecular weight 975.4, InChIKey JJGBFZZXKPWGCW-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
69
H-bond acceptors
12
H-bond donors
0
Rotatable bonds
47
Ring count
6
Aromatic rings
0
Topological polar surface area
154.08 Ų
Computed LogP
12.69
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
1,1',1''-(1,2,3-Propanetriyl) tris(3-((3-pentyl-2-oxiranyl)methyl)-2-oxiraneoctanoate) (CAS 8013-07-8) is maintained as a commercial cas reference with formula C57H98O12, molecular weight 975. 40 g/mol, PubChem CID 71306824.
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.