Research chemical
CAS Number: 2719751-36-5
Product details
For laboratory research and professional procurement workflows.
PubChem CID
156869636
Exact Mass
288.94624
InChIKey
PKACDBFFKOABTK-UHFFFAOYSA-N
IUPAC Name
2-[3-bromo-5-(trifluoromethyl)-2-pyridinyl]propanedinitrile
SMILES String
N#CC(C#N)c1ncc(C(F)(F)F)cc1Br
Appearance
2-(3-Bromo-5-(trifluoromethyl)pyridin-2-yl)malononitrile is identified by CAS 2719751-36-5, with molecular formula C9H3BrF3N3, molecular weight 290.04, InChIKey PKACDBFFKOABTK-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.
white to off-white crystalline powder
Physical State
solid
Melting Point
120.0 °C
Boiling Point
350.0 °C
Density
1.65 g/cm³
Water Solubility
sparingly soluble to insoluble
Flash Point
180.0 °C
Vapor Pressure
Estimated value, unit not specified
Autoignition Temp
350.0 °C
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
16
H-bond acceptors
3
H-bond donors
0
Rotatable bonds
1
Ring count
1
Aromatic rings
1
Topological polar surface area
60.47 Ų
Computed LogP
2.99
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
2-(3-Bromo-5-(trifluoromethyl)pyridin-2-yl)malononitrile is a research-use chemical featuring a pyridine core substituted with bromine, a trifluoromethyl group, and a malononitrile moiety.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Primarily intended for research and development purposes, 2-(3-Bromo-5-(trifluoromethyl)pyridin-2-yl)malononitrile is utilized as a key synthetic intermediate.
Documentation needs
Handle 2-(3-Bromo-5-(trifluoromethyl)pyridin-2-yl)malononitrile with appropriate personal protective equipment, including chemical-resistant gloves, safety glasses or goggles, and a lab coat.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.