Research chemical
CAS Number: 912457-08-0
![(11aS)-(-)-10,11,12,13-Tetrahydro-5-(1,1-dimethylethyl)diindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin molecular structure, CAS 912457-08-0](/structure-images/912457-08-0.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
11961714
Exact Mass
338.14356
InChIKey
LLEZTIOCARPMMS-UHFFFAOYSA-N
IUPAC Name
12-tert-butyl-4,5,6,7-tetrahydroiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocine
SMILES String
CC(C)(C)P1OC2=CC=CC(CC3)=C2C43C5=C(C=CC=C5O1)CC4
Appearance
(11aS)-(-)-10,11,12,13-Tetrahydro-5-(1,1-dimethylethyl)diindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin is identified by CAS 912457-08-0, with molecular formula C21H23O2P, molecular weight 338.38, InChIKey LLEZTIOCARPMMS-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.
Powder or crystals
Physical State
powder or crystals or crystal
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
24
H-bond acceptors
2
H-bond donors
0
Rotatable bonds
0
Ring count
5
Aromatic rings
2
Topological polar surface area
18.46 Ų
Computed LogP
5.75
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
organophosphorus reagent
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
Research Catalog Compound with Available Documentation (CAS 912457-08-0) is listed for phosphine ligand sourcing for catalyst or coordination screening.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Typical research procurement context: ligand-focused research workflows where steric and electronic fit are reviewed by the buyer, 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.
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 RequestNon-public references are shown as text only and do not imply equivalence, availability, or shared use.