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4-Propoxyphenyl 4-pentylbenzoate
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
326.1881946919999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₆O₃
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canonical SMILES
CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCC
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Identifiers
InChI
InChI=1S/C21H26O3/c1-3-5-6-7-17-8-10-18(11-9-17)21(22)24-20-14-12-19(13-15-20)23-16-4-2/h8-15H,3-7,16H2,1-2H3
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InChIKey
AURUXUJEIPXGBA-UHFFFAOYSA-N
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CAS Registry Number
50649-63-3
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PubChem CID
14985146
1 reference
matched by identifier from
InChIKey
InChIKey
AURUXUJEIPXGBA-UHFFFAOYSA-N
UniChem compound ID
63595036
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30566563
1 reference
matched by identifier from
InChIKey
InChIKey
AURUXUJEIPXGBA-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30517338
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