2-Propanone, O-(1-oxo-2-(4-(4-(trifluoromethyl)phenoxy)pheoxy)propyl)oxime

HCID 3036772

Basic information

CAS
72131-80-7
Standard SMILES
CC(C)=NOC(=O)C(C)Oc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1
InChIKey
IBHCSFXTRODDNR-UHFFFAOYSA-N
Molecular formula
C19H18F3NO4
Average molar mass
381.3 g/mol
Monoisotopic mass
381.11879272

Names & identifiers

Preferred name
2-Propanone, O-(1-oxo-2-(4-(4-(trifluoromethyl)phenoxy)pheoxy)propyl)oxime
IUPAC
(propan-2-ylideneamino) 2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propanoate

Names & synonyms

72131-80-72-Propanone, O-(1-oxo-2-(4-(4-(trifluoromethyl)phenoxy)pheoxy)propyl)oximeSCHEMBL11149620DTXSID601033202acetone O-[2-[p-(p-trifluoromethylphenoxy)phenoxy]propionyl]-oxime2-Propanone, O-[1-Oxo-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]propyl]oxime1-Propanone, 1-[[(1-methylethylidene)amino]oxy]-2-[4-[4-(trifluoromethyl)phenoxy]phenoxy]-

Database identifiers

CAS
72131-80-7
PubChem CID
3036772
DTXSID
DTXSID601033202

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
57.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
27

Related reactions

3 records

Compound notes

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