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(Q83116991)
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Hexyl isotridecyl phthalate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
432.3239598879999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₄O₄
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canonical SMILES
CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCC(C)C
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Identifiers
InChI
InChI=1S/C27H44O4/c1-4-5-6-16-21-30-26(28)24-19-14-15-20-25(24)27(29)31-22-17-12-10-8-7-9-11-13-18-23(2)3/h14-15,19-20,23H,4-13,16-18,21-22H2,1-3H3
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InChIKey
KFKFOSIUAMETNI-UHFFFAOYSA-N
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CAS Registry Number
85851-89-4
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PubChem CID
56842585
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UniChem compound ID
42424023
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40235132
1 reference
matched by identifier from
InChIKey
InChIKey
KFKFOSIUAMETNI-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40157623
0 references
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