Research chemical
CAS Number: 436096-49-0
Product details
For laboratory research and professional procurement workflows.
PubChem CID
1134110
Exact Mass
233.085207
InChIKey
AWHXVGUEMADTRX-UHFFFAOYSA-N
SMILES String
CCc1nc2ccc(F)cc2c(C(=O)O)c1C
Appearance
White solid
Physical State
Solid
2-Ethyl-6-fluoro-3-methylquinoline-4-carboxylic acid is identified by CAS 436096-49-0, with molecular formula C13H12FNO2, molecular weight 233.24, InChIKey AWHXVGUEMADTRX-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
200.0 °C
Boiling Point
400.0 °C
Density
1.31 g/cm³
Water Solubility
Slightly soluble
Flash Point
202.7 °C
Vapor Pressure
Estimated value, unit not specified
Autoignition Temp
420.0 °C
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
17
H-bond acceptors
3
H-bond donors
1
Rotatable bonds
2
Ring count
2
Aromatic rings
2
Topological polar surface area
50.19 Ų
Computed LogP
2.94
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-Ethyl-6-fluoro-3-methylquinoline-4-carboxylic acid is a quinoline derivative featuring ethyl, fluoro, and methyl substituents, along with a carboxylic acid group.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
This quinoline derivative is intended for research and development purposes as a chemical intermediate or building block in synthetic organic chemistry, particularly for creating novel heterocyclic compounds.
Documentation needs
Handle 2-Ethyl-6-fluoro-3-methylquinoline-4-carboxylic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat. Avoid inhalation, ingestion, and skin 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 RequestCertificate 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