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CHEBI:266039 - 4-methoxyphenylethylamine

Default Structure
ChEBI IDCHEBI:266039
ChEBI Name4-methoxyphenylethylamine
Stars
DefinitionA primary amino compound consisting of ethylamine having a 4-methoxyphenyl substituent at the 2-position.
Last Modified22 December 2015
DownloadsMolfile
FormulaC9H13NO
Net Charge0
Average Mass151.209
Monoisotopic Mass151.09971
SMILESCOc1ccc(CCN)cc1
InChIInChI=1S/C9H13NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7,10H2,1H3
InChIKeyLTPVSOCPYWDIFU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
4-methoxyphenylethylamine (CHEBI:266039) has parent hydride 2-phenylethylamine (CHEBI:18397)
4-methoxyphenylethylamine (CHEBI:266039) is a primary amino compound (CHEBI:50994)
Incoming Relation(s)
Cuscuta propenamide 1 (CHEBI:65700) has functional parent 4-methoxyphenylethylamine (CHEBI:266039)
N,O-dimethyltyramine (CHEBI:75143) has functional parent 4-methoxyphenylethylamine (CHEBI:266039)
IUPAC Name 
2-(4-methoxyphenyl)ethanamine
Synonyms  Source
2-(4-Methoxyphenyl)ethanamineNIST Chemistry WebBook
2-(4-Methoxyphenyl)ethylamineChemIDplus
2-(p-Methoxyphenyl)ethylamineChemIDplus
4-Methoxy-2-phenethylamineChemIDplus
4-MethoxybenzeneethanamineChemIDplus
4-MethoxyphenethylamineNIST Chemistry WebBook
Registry NumbersSources
Gmelin:2093996Gmelin
Reaxys:508967Reaxys
CAS:55-81-2ChemIDplus
CAS:55-81-2NIST Chemistry WebBook
Citations