Research chemical
CAS Number: 1528-49-0

Product details
For laboratory research and professional procurement workflows.
PubChem CID
73718
Exact Mass
462.298139
InChIKey
MXHBQKVKHGQWRB-UHFFFAOYSA-N
SMILES String
CCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCC)C(=O)OCCCCCC
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.
Trihexyl benzene-1,2,4-tricarboxylate is identified by CAS 1528-49-0, with molecular formula C27H42O6, molecular weight 462.6, InChIKey MXHBQKVKHGQWRB-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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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
33
H-bond acceptors
6
H-bond donors
0
Rotatable bonds
18
Ring count
1
Aromatic rings
1
Topological polar surface area
78.9 Ų
Computed LogP
6.9
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
Trihexyl benzene-1,2,4-tricarboxylate (CAS 1528-49-0) is maintained as a commercial cas reference with formula C27H42O6, molecular weight 462. 60 g/mol, PubChem CID 73718.
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.