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(Q82627871)
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English
Cycloocta-1,3,5,7-tetraene-1-carbonyl chloride
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
166.018542524
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₉H₇ClO
0 references
canonical SMILES
O=C(Cl)C1=C/C=C\C=C/C=C\1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
C\1=C\C=C/C(=C\C=C1)/C(=O)Cl
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Identifiers
InChI
InChI=1S/C9H7ClO/c10-9(11)8-6-4-2-1-3-5-7-8/h1-7H/b2-1-,3-1?,4-2?,5-3-,6-4-,7-5?,8-6?,8-7+
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InChIKey
RUTRLNDKHNOGFV-FXPPOMFJSA-N
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CAS Registry Number
663618-22-2
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PubChem CID
45081394
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UniChem compound ID
43893416
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50697848
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DSSTOX compound identifier
DTXCID50648597
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