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(Q82891738)
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English
6-(Aziridin-1-yl)-9-benzyl-8-chloro-9H-purine
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
285.732
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₂ClN₅
0 references
canonical SMILES
C1CN1C2=NC=NC3=C2N=C(N3CC4=CC=CC=C4)Cl
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Identifiers
InChI
InChI=1S/C14H12ClN5/c15-14-18-11-12(19-6-7-19)16-9-17-13(11)20(14)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2
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InChIKey
RJZDHHLHTFYBIC-UHFFFAOYSA-N
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CAS Registry Number
92291-24-2
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PubChem CID
246374
1 reference
matched by identifier from
InChIKey
InChIKey
RJZDHHLHTFYBIC-UHFFFAOYSA-N
UniChem compound ID
44822385
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80919262
1 reference
matched by identifier from
InChIKey
InChIKey
RJZDHHLHTFYBIC-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID201348196
0 references
NSC number
59331
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