Research chemical
CAS Number: 959271-96-6
Product details
For laboratory research and professional procurement workflows.
PubChem CID
6421032
Exact Mass
286.012075
InChIKey
MJVGKFJOTCTMDJ-UHFFFAOYSA-N
SMILES String
COc1ccc2nc(C(F)(F)F)c(C#N)c(Cl)c2c1
Appearance
White crystalline powder
Physical State
Solid
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.
4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile is identified by CAS 959271-96-6, with molecular formula C12H6ClF3N2O, molecular weight 286.63, InChIKey MJVGKFJOTCTMDJ-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.
Melting Point
165.0 °C
Boiling Point
330.0 °C
Density
1.51 g/cm³
Water Solubility
Insoluble
Flash Point
159.9 °C
Vapor Pressure
Estimated value, unit not specified
Autoignition Temp
410.0 °C
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
19
H-bond acceptors
3
H-bond donors
0
Rotatable bonds
1
Ring count
2
Aromatic rings
2
Topological polar surface area
45.91 Ų
Computed LogP
3.79
Fragment-like structure rule
Yes
Lead-like structure rule
Yes
Drug-like structure rule
Yes
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
A quinoline derivative featuring chloro, methoxy, trifluoromethyl, and carbonitrile functionalities, 4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile (CAS 959271-96-6) is a research-use chemical.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
This quinoline derivative is suitable for research applications in organic synthesis, medicinal chemistry, and materials science.
Documentation needs
Handle 4-Chloro-6-methoxy-2-(trifluoromethyl)quinoline-3-carbonitrile in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat, to prevent skin and eye contact.
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 RequestCompliance: standard-ruo
Shipment review: Required
Certificate of Analysis (COA): By request
Supplier Safety Data Sheet (SDS): By request
Purity 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
DSL: pending; AICS: pending; ENCS: pending; ICSR: pending; TSCA: pending; IECSC: pending; INSQR: pending; REACH: pending; K-REACH: pending; SEA_Regulatory: pending
Registration values are catalog reference status cues and may require jurisdiction-specific review.