Research chemical
CAS Number: 3051-27-2
Product details
For laboratory research and professional procurement workflows.
PubChem CID
76453
Exact Mass
168.0245
InChIKey
BSXCLFYNJYBVPM-UHFFFAOYSA-N
IUPAC Name
1-thiophen-2-ylbutane-1,3-dione
SMILES String
CC(=O)CC(=O)C1=CC=CS1
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.
1-(Thiophen-2-yl)butane-1,3-dione is identified by CAS 3051-27-2, with molecular formula C8H8O2S, molecular weight 168.21, InChIKey BSXCLFYNJYBVPM-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
11
H-bond acceptors
2
H-bond donors
0
Rotatable bonds
3
Ring count
1
Aromatic rings
1
Topological polar surface area
34.14 Ų
Computed LogP
1.91
Fragment-like structure rule
Yes
Lead-like structure rule
Yes
Drug-like structure rule
Yes
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-(Thiophen-2-yl)butane-1,3-dione catalog reference for CAS 3051-27-2.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Research chemical sourcing. Custom synthesis and catalog availability review.
Documentation needs
COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS Request