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(Q83077854)
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English
1-(1,3-Benzodioxol-5-yl)piperazine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
206.105527688
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₄N₂O₂
0 references
canonical SMILES
C1CN(CCN1)C2=CC3=C(C=C2)OCO3
0 references
Identifiers
InChI
InChI=1S/C11H14N2O2/c1-2-10-11(15-8-14-10)7-9(1)13-5-3-12-4-6-13/h1-2,7,12H,3-6,8H2
0 references
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
0 references
CAS Registry Number
55827-51-5
1 reference
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=55827-51-5
PubChem CID
4742003
1 reference
matched by identifier from
InChIKey
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL254552
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
UniChem compound ID
198499
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70204417
1 reference
matched by identifier from
InChIKey
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70126908
0 references
UNII
M4SN5SX6NS
1 reference
matched by identifier from
InChIKey
InChIKey
QNCWKECHSBDMPF-UHFFFAOYSA-N
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