CHEBI:146226 - 1-(2-chlorophenyl)-2-isopropylaminoethanol

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ChEBI Name 1-(2-chlorophenyl)-2-isopropylaminoethanol
ChEBI ID CHEBI:146226
Definition A member of the class of monochlorobenzenes that is chlorobenzene which is substituted by a 1-hydroxy-2-[(propan-2-yl)amino]ethyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C11H16ClNO
Net Charge 0
Average Mass 213.710
Monoisotopic Mass 213.09204
InChI InChI=1S/C11H16ClNO/c1-8(2)13-7-11(14)9-5-3-4-6-10(9)12/h3-6,8,11,13-14H,7H2,1-2H3
InChIKey SSMSBSWKLKKXGG-UHFFFAOYSA-N
SMILES C1(=C(Cl)C=CC=C1)C(CNC(C)C)O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-(2-chlorophenyl)-2-isopropylaminoethanol (CHEBI:146226) is a ethanolamines (CHEBI:23981)
1-(2-chlorophenyl)-2-isopropylaminoethanol (CHEBI:146226) is a monochlorobenzenes (CHEBI:83403)
1-(2-chlorophenyl)-2-isopropylaminoethanol (CHEBI:146226) is a secondary amino compound (CHEBI:50995)
Incoming (R)-clorprenaline (CHEBI:146224) is a 1-(2-chlorophenyl)-2-isopropylaminoethanol (CHEBI:146226)
(S)-clorprenaline (CHEBI:146225) is a 1-(2-chlorophenyl)-2-isopropylaminoethanol (CHEBI:146226)
IUPAC Name
1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol
Synonym Source
1-(2-chlorophenyl)-2-[(propan-2-yl)amino]ethan-1-ol IUPAC
Last Modified
26 February 2020
General Comment
2020-02-26 This is material with unspecified stereochemistry. There are separate entries for the racemate, clorprenaline and its individual enantiomers, (R)- and (S)-clorprenaline.