Research chemical
CAS Number: 16495-04-8
Product details
For laboratory research and professional procurement workflows.
PubChem CID
13644870
Exact Mass
336.103145
InChIKey
HBMUWOSOGHUWSS-INIZCTEOSA-N
IUPAC Name
[(2S)-2-hydroxy-3-phenylmethoxypropyl] 4-methylbenzenesulfonate
SMILES String
Cc1ccc(S(=O)(=O)OC[C@@H](O)COCc2ccccc2)cc1
No physical property values available.
1,2-Propanediol, 3-(phenylmethoxy)-, 1-(4-methylbenzenesulfonate), (2S)- is identified by CAS 16495-04-8, with molecular formula C17H20O5S, molecular weight 336.4, InChIKey HBMUWOSOGHUWSS-INIZCTEOSA-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
2.3
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
23
H-bond acceptors
5
H-bond donors
1
Rotatable bonds
8
Ring count
2
Aromatic rings
2
Topological polar surface area
72.83 Ų
Computed LogP
2.28
Fragment-like structure rule
No
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
1,2-Propanediol, 3-(phenylmethoxy)-, 1-(4-methylbenzenesulfonate), (2S)- (CAS 16495-04-8) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C17H20O5S and molecular weight 336. 40 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
SDS signal word: Warning; hazard codes: H302, H315, H319, H335; For research use only.
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 RequestPurity and pack size confirmation: By request
Availability and lead time review: Confirmed by RFQ
Shipment documentation review: By request
For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference