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(Q82604399)
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English
Ethyl 3-amino-5-fluoro-4-methylbenzoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
197.2066
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₀H₁₂FNO₂
0 references
canonical SMILES
CCOC(=O)C1=CC(=C(C(=C1)F)C)N
0 references
Identifiers
InChI
InChI=1S/C10H12FNO2/c1-3-14-10(13)7-4-8(11)6(2)9(12)5-7/h4-5H,3,12H2,1-2H3
0 references
InChIKey
SQVYXIRWFLXDKS-UHFFFAOYSA-N
0 references
CAS Registry Number
713-47-3
0 references
PubChem CID
52982956
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
SQVYXIRWFLXDKS-UHFFFAOYSA-N
UniChem compound ID
58455827
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30680697
1 reference
matched by identifier from
InChIKey
InChIKey
SQVYXIRWFLXDKS-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70631446
0 references
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