NAVIGATION


4'-Formylbenzo-15-crown 5-ether

Catalog Number
ACM60835736
CAS Number
60835-73-6
Product Name
4'-Formylbenzo-15-crown 5-ether
Structure
Category
Macrocycles; Supramolecular Host Materials
IUPAC Name
2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde
Molecular Weight
296.31g/mol
Molecular Formula
C15H20O6
Canonical SMILES
C1COCCOC2=C(C=C(C=C2)C=O)OCCOCCO1
InChI
InChI=1S/C15H20O6/c16-12-13-1-2-14-15(11-13)21-10-8-19-6-4-17-3-5-18-7-9-20-14/h1-2,11-12H,3-10H2
InChI Key
MBJIKIAWNPEHOR-UHFFFAOYSA-N
Purity
>98.0%(GC)
Complexity
285
Covalently-Bonded Unit Count
1
Exact Mass
296.125988g/mol
Formal Charge
0
Heavy Atom Count
21
Monoisotopic Mass
296.125988g/mol
NSC Number
288923
Rotatable Bond Count
1
XLogP3
0.5
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