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4-(3,4-dichlorophenyl)-2-((dimethylamino)methylene)-3,4-dihydronaphthalen-1(2H)-one

HCID 3755488
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)C=C1CC(c2ccc(Cl)c(Cl)c2)c2ccccc2C1=O
InChIKey
CZLNUOUWSSNILK-UHFFFAOYSA-N
Molecular formula
C19H17Cl2NO
Average molar mass
346.2 g/mol

Names & identifiers

Preferred name
4-(3,4-dichlorophenyl)-2-((dimethylamino)methylene)-3,4-dihydronaphthalen-1(2H)-one
IUPAC
4-(3,4-dichlorophenyl)-2-(dimethylaminomethylidene)-3,4-dihydronaphthalen-1-one

Names & synonyms

SCHEMBL2488855CZLNUOUWSSNILK-UHFFFAOYSA-N4-(3,4-dichlorophenyl)-2-((dimethylamino)methylene)-3,4-dihydronaphthalen-1(2H)-one

Database identifiers

PubChem CID
3755488

Properties

Computed structural propertiesFilling in

XLogP
5.1
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
23
Formal charge
0
Complexity
476

Related reactions

2 records
New reaction record
HRID 829180 reaction equation
HRID 829180As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1808038 reaction equation
HRID 1808038As reactantuspto-grants-2013_01

Compound notes

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