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CHEBI:63052 - Jeffamine ED-2001

ChEBI IDCHEBI:63052
ChEBI NameJeffamine ED-2001
Stars
DefinitionA diamine in which two primary amino groups are at either end of what is essentially a poly(ethylene glycol) (PEG)backbone, consisting of blocks of ethylene oxide and propylene oxide. In the diagram, m ~ 39,; (l + n) ~ 6. The compound is one of a series of related compounds commonly used to crystallise proteins.
Last Modified24 January 2012
SubmitterVincent Fazio
DownloadsMolfile
Formula(C2H4O)m.(C3H6O)l.(C3H6O)n.C3H10N2
Net Charge0
Average Mass234.340
Monoisotopic Mass234.19434
SMILESCC(N)COCCOC(C)COCC(C)N
InChIInChI=1S/C11H26N2O3/c1-9(12)6-14-4-5-16-11(3)8-15-7-10(2)13/h9-11H,4-8,12-13H2,1-3H3
InChIKeyRDSVPKGMYHANML-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
crystallisation adjutant  Chemical role played by a material when used to promote crystallisation.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Jeffamine ED-2001 (CHEBI:63052) has role crystallisation adjutant (CHEBI:63064)
Jeffamine ED-2001 (CHEBI:63052) is a diamine (CHEBI:23666)
Jeffamine ED-2001 (CHEBI:63052) is a jeffamine diamine (CHEBI:63066)
Jeffamine ED-2001 (CHEBI:63052) is a polyether (CHEBI:46774)
Synonym  Source
O,O'-bis(2-aminopropyl) polypropylene glycol-block-polyethylene glycol-block-polypropylene glycolChEBI