4-(Trifluoromethyl)umbelliferyl butyrate

Base Information

• Chemical Name: 4-(Trifluoromethyl)umbelliferyl butyrate
• CAS No.: 141573-64-0
• Molecular Formula: C14H11 F3 O4
• Molecular Weight: 300.23
• DSSTox Substance ID: DTXSID30350924
• Wikidata: Q82126995
• Mol file: 141573-64-0.mol

Synonyms:4-(Trifluoromethyl)umbelliferyl butyrate;141573-64-0;[2-oxo-4-(trifluoromethyl)chromen-7-yl] butanoate;SCHEMBL591198;DTXSID30350924;DIOAEWNUCWIZQK-UHFFFAOYSA-N;4-(Trifluromethyl)umbelliferyl butyrate;2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl butyrate

Chemical Property of 4-(Trifluoromethyl)umbelliferyl butyrate

Chemical Property:

• Melting Point: 93 °C(lit.)
• PSA: 56.51000
• LogP: 3.51730
• Storage Temp.: −20°C
• Solubility.: 2-methoxyethanol: soluble
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 300.06094331
• Heavy Atom Count: 21
• Complexity: 456

Purity/Quality:

99%min ^*data from raw suppliers

4-(TRIFLUOROMETHYL)UMBELLIFERYL BUTYRATE 95.00% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F