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(Q82047949)
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N-(3-Oxobutyl)phthalimide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
217.073893212
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₁NO₃
0 references
canonical SMILES
CC(=O)CCN1C(=O)C2=CC=CC=C2C1=O
0 references
Identifiers
InChI
InChI=1S/C12H11NO3/c1-8(14)6-7-13-11(15)9-4-2-3-5-10(9)12(13)16/h2-5H,6-7H2,1H3
0 references
InChIKey
ONTXCMXICQNNNO-UHFFFAOYSA-N
0 references
CAS Registry Number
3783-77-5
1 reference
InChIKey
ONTXCMXICQNNNO-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=3783-77-5
PubChem CID
290728
1 reference
matched by identifier from
InChIKey
InChIKey
ONTXCMXICQNNNO-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL133683
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ONTXCMXICQNNNO-UHFFFAOYSA-N
UniChem compound ID
103968
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20302891
1 reference
matched by identifier from
InChIKey
InChIKey
ONTXCMXICQNNNO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40254025
0 references
NSC number
154919
0 references
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