2-(5-Carboxyfurfurylthio)-5-(trifluoromethyl)pyridine

Base Information

• Chemical Name: 2-(5-Carboxyfurfurylthio)-5-(trifluoromethyl)pyridine
• CAS No.: 238742-86-4
• Molecular Formula: C12H8 F3 N O3 S
• Molecular Weight: 303.26
• Hs Code.: 2933399990
• DSSTox Substance ID: DTXSID70371375
• Wikidata: Q82158685
• Mol file: 238742-86-4.mol

Synonyms:238742-86-4;2-(5-Carboxyfurfurylthio)-5-(trifluoromethyl)pyridine;5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylic acid;5-({[5-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)furan-2-carboxylic acid;5-[5-(Trifluoromethyl)-2-pyridyl]thiomethyl)-2-furoic acid;5-(((5-(Trifluoromethyl)pyridin-2-yl)thio)methyl)furan-2-carboxylic acid;Maybridge1_004760;5-({[5-(Trifluoromethyl)-2-pyridyl]thio}methyl)-2-furoic acid;HMS555A08;DTXSID70371375;MYDIGMNTURCKBI-UHFFFAOYSA-N;MFCD00099971;AKOS009159477;PS-7119;SB60929;CS-0320632;FT-0619557;W-206860;5-[5-(Trifluoromethyl)pyridin-2-yl]thiomethyl)-2-furoic acid;2-(5-carboxyfurfurylthio)-5-(trifluoromethyl)pyridine, AldrichCPR;5-({[5-(Trifluoromethyl)pyridin-2-yl]thio}methyl)-2-furoic acid;5-(((5-(Trifluoromethyl)pyridin-2-yl)thio)methyl)furan-2-carboxylicacid;5-((5-(trifluoromethyl)pyridin-2-ylthio)methyl)furan-2-carboxylic acid

Chemical Property of 2-(5-Carboxyfurfurylthio)-5-(trifluoromethyl)pyridine

Chemical Property:

• Vapor Pressure: 1.65E-08mmHg at 25°C
• Melting Point: 176-178
• Refractive Index: 1.577
• Boiling Point: 439.7°Cat760mmHg
• PKA: 3.10±0.10(Predicted)
• Flash Point: 219.7°C
• PSA: 88.63000
• Density: 1.53g/cm³
• LogP: 3.68390
• Sensitive.: Stench
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 303.01769878
• Heavy Atom Count: 20
• Complexity: 353

Purity/Quality:

98%min ^*data from raw suppliers

5-[5-(Trifluoromethyl)pyridin-2-yl]thiomethyl)-2-furoic acid 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 20/21/22-36/37/38-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=NC=C1C(F)(F)F)SCC2=CC=C(O2)C(=O)O