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10-Ethoxy-9-anthracenecarbaldehyde

HCID 13375404
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOc1c2ccccc2c(C=O)c2ccccc12
InChIKey
UBBCCUWEPZLHFQ-UHFFFAOYSA-N
Molecular formula
C17H14O2
Average molar mass
250.29 g/mol

Names & identifiers

Preferred name
10-Ethoxy-9-anthracenecarbaldehyde
IUPAC
10-ethoxyanthracene-9-carbaldehyde

Names & synonyms

SCHEMBL10488258UBBCCUWEPZLHFQ-UHFFFAOYSA-N10-ethoxy-9-anthracenecarbaldehyde

Database identifiers

PubChem CID
13375404

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
290

Related reactions

6 records
New reaction record
HRID 89267 reaction equation
HRID 89267As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 104780 reaction equation
HRID 104780As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1381746 reaction equation
HRID 1381746As productuspto-grants-1989_02
HRID 1381782 reaction equation
HRID 1381782As productuspto-grants-1989_02
HRID 2413623 reaction equation
HRID 2413623As productuspto-grants-1988_01
HRID 2413646 reaction equation
HRID 2413646As productuspto-grants-1988_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes