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Ethyl 2-[4-(trifluoromethyl)phenoxy]acetate

HCID 18317849
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
442125-30-6
Standard SMILES
CCOC(=O)COc1ccc(C(F)(F)F)cc1
InChIKey
JOWZWSDDZGUKFO-UHFFFAOYSA-N
Molecular formula
C11H11F3O3
Average molar mass
248.2 g/mol
Monoisotopic mass
248.06602869

Names & identifiers

Preferred name
Ethyl 2-[4-(trifluoromethyl)phenoxy]acetate
IUPAC
ethyl 2-[4-(trifluoromethyl)phenoxy]acetate
English name
(4-TRIFLUOROMETHYLPHENOXY) ACETIC ACID ETHYL ESTER
Molecular formula
C11H11F3O3
Molecular weight
248.2

Names & synonyms

442125-30-6Ethyl 2-[4-(trifluoromethyl)phenoxy]acetateEthyl 2-(4-(trifluoromethyl)phenoxy)acetateMFCD06659699(4-TRIFLUOROMETHYLPHENOXY) ACETIC ACID ETHYL ESTERAcetic acid,2-[4-(trifluoromethyl)phenoxy]-, ethyl esterSCHEMBL5279675DTXSID80592751JOWZWSDDZGUKFO-UHFFFAOYSA-NAKOS008952123AB26120BS-32444
Show more names
Ethyl [4-(trifluoromethyl)phenoxy]acetateEthyl2-(4-(trifluoromethyl)phenoxy)acetateCS-0209983D78580

Database identifiers

CAS
442125-30-6
PubChem CID
18317849
DTXSID
DTXSID80592751

Properties

Computed structural propertiesFilling in

XLogP
3.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
245

Physicochemical properties

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

Related reactions

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Compound notes

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