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1-(2-Methoxyethyl)-6-phenylazepan-2-one

HCID 22293183
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COCCN1CC(c2ccccc2)CCCC1=O
InChIKey
ZJPZAKQXVOKIOB-UHFFFAOYSA-N
Molecular formula
C15H21NO2
Average molar mass
247.33 g/mol

Names & identifiers

Preferred name
1-(2-Methoxyethyl)-6-phenylazepan-2-one
IUPAC
1-(2-methoxyethyl)-6-phenylazepan-2-one

Names & synonyms

SCHEMBL1198466ZJPZAKQXVOKIOB-UHFFFAOYSA-N1-(2-Methoxyethyl)-6-phenylazepan-2-one

Database identifiers

PubChem CID
22293183

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
261

Related reactions

15 records
New reaction record
HRID 20125 reaction equation
HRID 20125As productuspto-grants-2010_06
HRID 20126 reaction equation
HRID 20126As reactantuspto-grants-2010_06
HRID 271919 reaction equation
HRID 271919As productuspto-grants-2008_11
HRID 271920 reaction equation
HRID 271920As reactantuspto-grants-2008_11
HRID 493635 reaction equation
HRID 493635As productuspto-grants-2009_05
HRID 493636 reaction equation
HRID 493636As reactantuspto-grants-2009_05
HRID 501123 reaction equation
HRID 501123As productuspto-grants-2010_08
HRID 501124 reaction equation
HRID 501124As reactantuspto-grants-2010_08
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Compound notes

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