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2-Ethoxy-3-[4-(2-phenoxazin-10-ylethoxy)phenyl]propanoate (HCID 18172352)|Huagongshe
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Compound
2-Ethoxy-3-[4-(2-phenoxazin-10-ylethoxy)phenyl]propanoate
HCID
18172352
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCOC(Cc1ccc(OCCN2c3ccccc3Oc3ccccc32)cc1)C(=O)[O-]
InChIKey
WMUIIGVAWPWQAW-UHFFFAOYSA-M
Molecular formula
C25H24NO5-
Average molar mass
418.5 g/mol
Monoisotopic mass
418.16544787
Names & identifiers
Preferred name
2-Ethoxy-3-[4-(2-phenoxazin-10-ylethoxy)phenyl]propanoate
IUPAC
2-ethoxy-3-[4-(2-phenoxazin-10-ylethoxy)phenyl]propanoate
Database identifiers
PubChem CID
18172352
Properties
Computed structural properties
XLogP
5.6
Topological polar surface area
71.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
31
Formal charge
-1
Complexity
537
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Related reactions
1 records
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As solvent
HRID
811068
As product
Test data from https://doi.org/10.1039/C8SC04228D
Compound notes
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