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(Q82160131)
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English
phenyl(1H-pyrrol-1-yl)acetic acid
chemical compound
2-phenyl-2-pyrrol-1-ylacetic acid
α-phenyl-1H-pyrrole-1-acetic acid
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
201.2217
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₁NO₂
0 references
canonical SMILES
C1=CC=C(C=C1)C(C(=O)O)N2C=CC=C2
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Identifiers
InChI
InChI=1S/C12H11NO2/c14-12(15)11(13-8-4-5-9-13)10-6-2-1-3-7-10/h1-9,11H,(H,14,15)
0 references
InChIKey
FNRJAIIHCKGTCV-UHFFFAOYSA-N
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CAS Registry Number
105264-23-1
1 reference
stated in
SciFinder
PubChem CID
2741447
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
23385608
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50372426
0 references
DTXSID80876725
0 references
DSSTOX compound identifier
DTXCID50323458
0 references
DTXCID50895307
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