(4R)-4-Fluoro-L-glutamine - CAS 238418-71-8

Name: (4R)-4-Fluoro-L-glutamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB065226
Product Name:	(4R)-4-Fluoro-L-glutamine
CAS:	238418-71-8
Synonyms:	(2S,4R)-5-Amino-2-Ammonio-4-Fluoro-5-Oxopentanoate; DL-Erythro-4-Fluoroglutamine

Technical Data

Computed Properties

IUPAC Name:	(2S,4R)-2,5-diamino-4-fluoro-5-oxopentanoic acid
Description:	(4R)-4-Fluoro-L-glutamine is used as an intermediate in the preparation of optically pure fluoroglutamines, and their 18F-labeled derivative form with biological activity that functions as a metabolic imaging agents for tumors.
Molecular Weight:	164.13
Molecular Formula:	C5H9FN2O3
Canonical SMILES:	C(C(C(=O)O)N)C(C(=O)N)F
InChI:	InChI=1S/C5H9FN2O3/c6-2(4(8)9)1-3(7)5(10)11/h2-3H,1,7H2,(H2,8,9)(H,10,11)/t2-,3+/m1/s1
InChI Key:	PGEYFCBAWGQSGT-GBXIJSLDSA-N

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Related Functional Groups

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Complexity:	173
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	164.05972032
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	164.05972032
Rotatable Bond Count:	4
Topological Polar Surface Area:	106Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-3.7