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Basic information
- CAS
860651-06-5- Standard SMILES
CCOC(=O)Cn1nc(C)n(-c2ccc(F)cc2)c1=O- InChIKey
UJOQOYLNCVSAHO-UHFFFAOYSA-N- Molecular formula
- C13H14FN3O3
- Average molar mass
- 279.271 g/mol
- Monoisotopic mass
- 279.10191953
Names & identifiers
- Preferred name
- Ethyl 4-(4-fluorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazole-1-acetate
- IUPAC
- Ethyl [4-(4-fluorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetate
- English name
- ETHYL 2-[4-(4-FLUOROPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]ACETATE
- Molecular formula
- C13H14FN3O3
- Molecular weight
- 279.27
Names & synonyms
ethyl 2-[4-(4-fluorophenyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]acetateETHYL 2-[4-(4-FLUOROPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]ACETATE1H-1,2,4-Triazole-1-acetic acid, 4-(4-fluorophenyl)-4,5-dihydro-3-methyl-5-oxo-, ethyl ester
Database identifiers
- CAS
860651-06-5- PubChem CID
- 1482012
- DTXSID
DTXSID001136026- ChEMBL
CHEMBL1548256
Properties
Physicochemical properties
- Boiling point
- 369.8 · 369.8±52.0 °C(Predicted)
- Density
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- pka
- 2.4 · 2.40±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
Related reactions
0 records
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Compound notes
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