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(Q81997915)
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English
Cyclohexanecarboxylic acid, 4-pentyl-, 4-(pentyloxy)phenyl ester
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
360.26644501199996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₆O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCOc1ccc(OC(=O)C2CCC(CCCCC)CC2)cc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C23H36O3/c1-3-5-7-9-19-10-12-20(13-11-19)23(24)26-22-16-14-21(15-17-22)25-18-8-6-4-2/h14-17,19-20H,3-13,18H2,1-2H3
0 references
InChIKey
NWXQRUYEAUDZIV-UHFFFAOYSA-N
0 references
CAS Registry Number
67679-66-7
1 reference
InChIKey
NWXQRUYEAUDZIV-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=67679-66-7
PubChem CID
105552
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
NWXQRUYEAUDZIV-UHFFFAOYSA-N
UniChem compound ID
26534441
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID1070567
1 reference
matched by identifier from
InChIKey
InChIKey
NWXQRUYEAUDZIV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID2044979
0 references
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