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Benzoic acid, 4-(trifluoromethyl)-, (4,5-dichloro-6-oxo-1(6H)-pyridazinyl)methyl ester

HCID 1474464
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
439107-91-2
Standard SMILES
O=C(OCn1ncc(Cl)c(Cl)c1=O)c1ccc(C(F)(F)F)cc1
InChIKey
VCQWDYKZRKWDIA-UHFFFAOYSA-N
Molecular formula
C13H7Cl2F3N2O3
Average molar mass
367.11 g/mol
Monoisotopic mass
365.9785821

Names & identifiers

Preferred name
Benzoic acid, 4-(trifluoromethyl)-, (4,5-dichloro-6-oxo-1(6H)-pyridazinyl)methyl ester
IUPAC
(4,5-Dichloro-6-oxopyridazin-1(6H)-yl)methyl 4-(trifluoromethyl)benzoate
English name
[4,5-Dichloro-6-oxo-1(6H)-pyridazinyl]methyl 4-(trifluoromethyl)benzenecarboxylate
Molecular formula
C13H7Cl2F3N2O3
Molecular weight
367.11

Names & synonyms

[4,5-Dichloro-6-oxo-1(6H)-pyridazinyl]methyl 4-(trifluoromethyl)benzenecarboxylateBenzoic acid, 4-(trifluoromethyl)-, (4,5-dichloro-6-oxo-1(6H)-pyridazinyl)methyl ester

Database identifiers

CAS
439107-91-2
PubChem CID
1474464
DTXSID
DTXSID001125803
ChEMBL
CHEMBL1447341

Properties

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

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