3-(3-Bromo-phenoxymethyl)-phenylamine

HCID 20112959
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Basic information

Standard SMILES
Nc1cccc(COc2cccc(Br)c2)c1
InChIKey
YTHBYNOOVFFHCM-UHFFFAOYSA-N
Molecular formula
C13H12BrNO
Average molar mass
278.14 g/mol
Monoisotopic mass
277.01023

Names & identifiers

Preferred name
3-(3-Bromo-phenoxymethyl)-phenylamine
IUPAC
3-[(3-bromophenoxy)methyl]aniline

Names & synonyms

SCHEMBL810741YTHBYNOOVFFHCM-UHFFFAOYSA-NAKOS0001484453-(3-Bromo-phenoxymethyl)-phenylamine

Database identifiers

PubChem CID
20112959

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
16

Related reactions

3 records
New reaction record

Compound notes

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