Research chemical
CAS Number: 112791-61-4
Product details
For laboratory research and professional procurement workflows.
PubChem CID
121920
Exact Mass
499.928712
InChIKey
MRVYFOANPDTYBY-UZAAGFTCSA-N
IUPAC Name
[(1S,2S,3R,4S,5R,6R)-2,3-dihydroxy-4,5,6-triphosphonooxycyclohexyl] dihydrogen phosphate
SMILES String
[C@H]1([C@@H]([C@@H]([C@H]([C@@H]([C@H]1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O)O
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.
D-Myo-Inositol 3,4,5,6-Tetrakisphosphate is identified by CAS 112791-61-4, with molecular formula C6H16O18P4, molecular weight 500.08, InChIKey MRVYFOANPDTYBY-UZAAGFTCSA-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
28
H-bond acceptors
18
H-bond donors
10
Rotatable bonds
8
Ring count
1
Aromatic rings
0
Topological polar surface area
307.5 Ų
Computed LogP
-3.37
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
phosphine ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
Yes
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
D-Myo-Inositol 3,4,5,6-Tetrakisphosphate (CAS 112791-61-4) is maintained as a cataloged research chemical with formula C6H16O18P4, molecular weight 500. 08 g/mol, PubChem CID 121920.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for identity verification, supplier-aware sourcing review, and RFQ preparation; structure-derived tags include phosphine-ligand motif.
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.