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(Q82809281)
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English
4-Cyanophenyl 4-[(4-dodecylbenzoyl)oxy]-3-methylbenzoate
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
525.2879087279999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₄H₃₉NO₄
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canonical SMILES
CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)C
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Identifiers
InChI
InChI=1S/C34H39NO4/c1-3-4-5-6-7-8-9-10-11-12-13-27-14-18-29(19-15-27)33(36)39-32-23-20-30(24-26(32)2)34(37)38-31-21-16-28(25-35)17-22-31/h14-24H,3-13H2,1-2H3
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InChIKey
UHSHYXMLQQIQNK-UHFFFAOYSA-N
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CAS Registry Number
71299-59-7
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PubChem CID
71404680
1 reference
matched by identifier from
InChIKey
InChIKey
UHSHYXMLQQIQNK-UHFFFAOYSA-N
UniChem compound ID
53991342
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40825512
1 reference
matched by identifier from
InChIKey
InChIKey
UHSHYXMLQQIQNK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60776254
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