[[1,4-Dihydro-4-oxo-6-(trifluoromethyl)-2-pyrimidinyl]thio]-acetic acid

• CAS: 836-12-4
• Catalog Number: ACM836124
• Category: Other Products
• Molecular Weight: 254.1864096
• Molecular Formula: C₇H₅F₃N₂O₃S
• Synonyms: [[1,4-DIHYDRO-4-OXO-6-(TRIFLUOROMETHYL)-2-PYRIMIDINYL]THIO]-ACETIC ACID;[[1,4-Dihydro-4-oxo-6-(trifluoromethyl)-2-pyrimidinyl]thio]-acetic acid
• IUPAC Name: 2-[[4-oxo-6-(trifluoromethyl)-1H-pyrimidin-2-yl]sulfanyl]acetic acid
• Canonical SMILES: C1=C(NC(=NC1=O)SCC(=O)O)C(F)(F)F
• InChI Key: WIYYPOWHFQWKAF-UHFFFAOYSA-N
• Boiling Point: 326.8ºC at 760 mmHg
• Flash Point: 151.4ºC
• Density: 1.73g/cm³
• Exact Mass: 253.99700
• H-Bond Acceptor: 7
• H-Bond Donor: 2