Research chemical
CAS Number: 386229-71-6
Product details
For laboratory research and professional procurement workflows.
PubChem CID
4611020
Exact Mass
695.14635
InChIKey
DZJCGEWZGVLAEE-UHFFFAOYSA-N
IUPAC Name
2-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]-5-(2-methylsulfonylsulfanylethylsulfamoyl)benzenesulfonate
SMILES String
CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)NCCSS(C)(=O)=O)cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1
No physical property values available.
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.
MTS-rhodamine is identified by CAS 386229-71-6, with molecular formula C30H37N3O8S4, molecular weight 695.9, InChIKey DZJCGEWZGVLAEE-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.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
45
H-bond acceptors
11
H-bond donors
1
Rotatable bonds
13
Ring count
4
Aromatic rings
2
Topological polar surface area
156.9 Ų
Computed LogP
3.74
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
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
MTS-rhodamine (CAS 386229-71-6) is maintained as a commercial cas reference with formula C30H37N3O8S4, molecular weight 695. 90 g/mol, PubChem CID 4611020.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include nitrogen-containing heterocycle.
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.