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CHEBI:64019 - 2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol]

ChEBI IDCHEBI:64019
ChEBI Name2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol]
Stars
ASCII Name2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol]
DefinitionA member of the class of chromanes that is 2,2'-iminodiethanol in which one hydrogen attached to each hydroxy-bearing carbon is replaced by a 6-fluorochroman-2-yl group.
Last Modified27 February 2012
SubmitterGareth Owen
DownloadsMolfile
FormulaC22H25F2NO4
Net Charge0
Average Mass405.441
Monoisotopic Mass405.17516
SMILESOC(CNCC(O)C1CCc2cc(F)ccc2O1)C1CCc2cc(F)ccc2O1
InChIInChI=1S/C22H25F2NO4/c23-15-3-7-19-13(9-15)1-5-21(28-19)17(26)11-25-12-18(27)22-6-2-14-10-16(24)4-8-20(14)29-22/h3-4,7-10,17-18,21-22,25-27H,1-2,5-6,11-12H2
InChIKeyKOHIRBRYDXPAMZ-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)
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019) is a chromanes (CHEBI:23230)
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019) is a diol (CHEBI:23824)
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019) is a organofluorine compound (CHEBI:37143)
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019) is a secondary alcohol (CHEBI:35681)
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019) is a secondary amino compound (CHEBI:50995)
Incoming Relation(s)
(R,S,S,S)-nebivolol (CHEBI:64020) is a 2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019)
(S,R,R,R)-nebivolol (CHEBI:64021) is a 2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol] (CHEBI:64019)
IUPAC Name 
2,2'-iminobis[1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol]
Synonyms  Source
α,α'-(iminobismethylene)bis-(6-fluoro-3,4-dihydro-2H-1-benzopyran-2-methanol)ChemIDplus
α,α'-(iminodimethylene)bis-(6-fluoro-2-chromanmethanol)ChEBI
1,1'-[bis(6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl)]-2,2'-iminodiethanolChEBI
1,1'-bis(6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl)-2,2'-iminodiethanolChEBI
Registry NumbersSources
Reaxys:8729344Reaxys
CAS:99200-09-6ChemIDplus