CHEBI:75337 - 2-(aminomethyl)-3,4,6-trichlorophenol

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ChEBI Name 2-(aminomethyl)-3,4,6-trichlorophenol
ChEBI ID CHEBI:75337
Definition A member of the class of trichlorophenols that is phenol substituted by chloro groups at positions 3, 4 and 6 and an aminomethyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C7H6Cl3NO
Net Charge 0
Average Mass 226.48800
Monoisotopic Mass 224.95150
InChI InChI=1S/C7H6Cl3NO/c8-4-1-5(9)7(12)3(2-11)6(4)10/h1,12H,2,11H2
InChIKey ZKOOKXLPQGZFCQ-UHFFFAOYSA-N
SMILES NCc1c(O)c(Cl)cc(Cl)c1Cl
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 2-(aminomethyl)-3,4,6-trichlorophenol (CHEBI:75337) has functional parent benzylamine (CHEBI:40538)
2-(aminomethyl)-3,4,6-trichlorophenol (CHEBI:75337) is a primary amino compound (CHEBI:50994)
2-(aminomethyl)-3,4,6-trichlorophenol (CHEBI:75337) is a trichlorophenols (CHEBI:15258)
Incoming 2-[(benzoylamino)methyl]-3,4,6-trichlorophenyl 4-nitrobenzoate (CHEBI:75336) has functional parent 2-(aminomethyl)-3,4,6-trichlorophenol (CHEBI:75337)
IUPAC Name
2-(aminomethyl)-3,4,6-trichlorophenol
Registry Number Type Source
2101332 Reaxys Registry Number Reaxys
Last Modified
27 August 2013