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(Q82008757)
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English
tert-butyl 4-methylphenyl sulfone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
212.087100752
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₆O₂S
0 references
canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)C(C)(C)C
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Identifiers
InChI
InChI=1S/C11H16O2S/c1-9-5-7-10(8-6-9)14(12,13)11(2,3)4/h5-8H,1-4H3
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InChIKey
BNOXKZIHCOIFLF-UHFFFAOYSA-N
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CAS Registry Number
5324-90-3
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PubChem CID
220264
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UniChem compound ID
14616312
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80277531
1 reference
matched by identifier from
InChIKey
InChIKey
BNOXKZIHCOIFLF-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80228689
0 references
NSC number
2746
0 references
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