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1-(4-bromophenyl)-N,N-dimethylethanamine

HCID 419262
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(c1ccc(Br)cc1)N(C)C
InChIKey
YUNJWUBNQZOPRY-UHFFFAOYSA-N
Molecular formula
C10H14BrN
Average molar mass
228.13 g/mol
Monoisotopic mass
227.03096

Names & identifiers

Preferred name
1-(4-bromophenyl)-N,N-dimethylethanamine
IUPAC
1-(4-bromophenyl)-N,N-dimethylethanamine

Names & synonyms

1-(4-bromophenyl)-N,N-dimethylethanamine140621-51-8N-[1-(4-bromophenyl)ethyl]-N,N-dimethylamine hydrochlorideC10H15BrClNSCHEMBL2382760YUNJWUBNQZOPRY-UHFFFAOYSA-N4167ADAKOS005171542(+/-)-1-dimethylamino-1-(4-bromophenyl)-ethane

Database identifiers

PubChem CID
419262

Properties

Computed structural propertiesFilling in

XLogP
2.9
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
128

Related reactions

3 records
New reaction record
HRID 1645811 reaction equation
HRID 1645811As reactantuspto-grants-1993_01
HRID 2255282 reaction equation
HRID 2255282As reactantuspto-grants-1993_08
HRID 2348367 reaction equation
HRID 2348367As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes