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(Q82169461)
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English
methyl 2-(trifluoromethoxy)benzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
220.1456
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₇F₃O₃
0 references
canonical SMILES
COC(=O)C1=CC=CC=C1OC(F)(F)F
0 references
Identifiers
InChI
InChI=1S/C9H7F3O3/c1-14-8(13)6-4-2-3-5-7(6)15-9(10,11)12/h2-5H,1H3
0 references
InChIKey
VDJYJSUDISVNRS-UHFFFAOYSA-N
0 references
CAS Registry Number
148437-99-4
0 references
PubChem CID
2775550
1 reference
matched by identifier from
InChIKey
InChIKey
VDJYJSUDISVNRS-UHFFFAOYSA-N
ChEBI ID
194867
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C9H7F3O3/c1-14-8(13)6-4-2-3-5-7(6)15-9(10,11)12/h2-5H,1H3
UniChem compound ID
12901972
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80379584
1 reference
matched by identifier from
InChIKey
InChIKey
VDJYJSUDISVNRS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80330610
0 references
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