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(Q82936520)
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English
3-Amino-3-(4-nitrophenyl)propanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
210.0640568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₁₀N₂O₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC(CC(=O)O)c1ccc([N+](=O)[O-])cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H10N2O4/c10-8(5-9(12)13)6-1-3-7(4-2-6)11(14)15/h1-4,8H,5,10H2,(H,12,13)
0 references
InChIKey
JVQPVKJZKRICRR-UHFFFAOYSA-N
0 references
CAS Registry Number
35005-61-9
0 references
PubChem CID
3796284
1 reference
matched by identifier from
InChIKey
InChIKey
JVQPVKJZKRICRR-UHFFFAOYSA-N
DSSTox substance ID
DTXSID50956447
1 reference
matched by identifier from
InChIKey
InChIKey
JVQPVKJZKRICRR-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID00837934
0 references
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