Research chemical
CAS Number: 66774-80-9
Product details
For laboratory research and professional procurement workflows.
PubChem CID
13519431
Exact Mass
366.186481
InChIKey
CZKSQENRQZPNOS-LFZDHENXSA-N
IUPAC Name
[(2S)-2-[(1R,3aR,4S,7aR)-4-hydroxy-7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl]propyl] 4-methylbenzenesulfonate
SMILES String
CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](C)[C@H]2CC[C@@H]3[C@@]2(CCC[C@@H]3O)C
No physical property values available.
Inhoffen Lythgoe Diol Monotosylate is identified by CAS 66774-80-9, with molecular formula C20H30O4S, molecular weight 366.5, InChIKey CZKSQENRQZPNOS-LFZDHENXSA-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.
XLogP
4.6
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
25
H-bond acceptors
4
H-bond donors
1
Rotatable bonds
5
Ring count
3
Aromatic rings
1
Topological polar surface area
63.6 Ų
Computed LogP
3.91
Fragment-like structure rule
No
Lead-like structure rule
No
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
Inhoffen Lythgoe Diol Monotosylate (CAS 66774-80-9) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C20H30O4S and molecular weight 366. 50 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research-stage medicinal chemistry and intermediate synthesis workflows.
Documentation needs
Consult the supplier SDS 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.