Research chemical
Bis(1-butyl-3-methylcyclopenta-2,4-dien-1-yl)zirconium(IV) chloride
CAS Number: 151840-68-5
Product details
Identity & specification
- Molecular formula
- C20H30Cl2Zr
- Molecular weight
- 432.58 g/mol
- Product type
- Research-use catalog compound
- Documentation
- COA / SDS available by request
For laboratory research and professional procurement workflows.
Technical identifiers
Show PubChem, InChIKey, IUPAC, and SMILES
PubChem CID
52987681
Exact Mass
430.07716
InChIKey
LJKJSEVMTCFGSH-UHFFFAOYSA-L
SMILES String
CC1=CC([Zr+2]C2(CCCC)C=C(C)C=C2)(CCCC)C=C1.[Cl-].[Cl-]
Physical Properties
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Computed Structure Descriptors
Show calculated structure fields
Heavy atom count
23
H-bond acceptors
0
H-bond donors
0
Rotatable bonds
8
Ring count
2
Aromatic rings
0
Topological polar surface area
0 Ų
Computed LogP
0.81
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
transition metal catalyst or complex
Precious metal motif
No
Transition metal motif
Yes
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.
Catalog Facts
Structural features
Research Catalog Compound - Transition Metal Catalyst or Complex (CAS 151840-68-5) is listed for transition metal catalyst or coordination-complex sourcing.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Typical research procurement context: metal-centered catalyst screening and ligand-set evaluation, with buyer review before selection.
Documentation needs
Preliminary handling notes only; confirm supplier SDS before handling. Review storage, transport, and documentation requirements internally before order acceptance.
Applications & Classification
Safety & Handling
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 RequestProcurement questions
What are the key identifiers for Bis(1-butyl-3-methylcyclopenta-2,4-dien-1-yl)zirconium(IV) chloride (CAS 151840-68-5)?
Bis(1-butyl-3-methylcyclopenta-2,4-dien-1-yl)zirconium(IV) chloride is identified by CAS 151840-68-5, with molecular formula C20H30Cl2Zr, molecular weight 432.58, InChIKey LJKJSEVMTCFGSH-UHFFFAOYSA-L.
Can I request a COA for CAS 151840-68-5?
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Can I request supplier SDS for Bis(1-butyl-3-methylcyclopenta-2,4-dien-1-yl)zirconium(IV) chloride?
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Is CAS 151840-68-5 available for quotation?
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Can MolGraph support bulk sourcing or custom synthesis review?
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.