chempirical

Fmoc-D-phenylalanine

C24H21NO4CAS 86123-10-6387.44 g/mol

Open in Covalent MOL file
OOHNHOO
CarbamateCarboxylic acid

Properties

Molecular formula
C24H21NO4
Molar mass
387.44 g/mol
Exact mass
387.1471 Da
logP
4.22Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
6
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
86123-10-6
SMILES
C1=CC=C(C=C1)C[C@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChIKey
SJVFAHZPLIXNDH-JOCHJYFZSA-N
InChI
InChI=1S/C24H21NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22H,14-15H2,(H,25,28)(H,26,27)/t22-/m1/s1

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Names and synonyms

1 names
  • (2R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-phenylpropanoic acid

Work with Fmoc-D-phenylalanine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Fmoc-L-phenylalanine35661-40-6Enantiomer Fmoc-phe-oh286460-71-7Enantiomer

Similar compounds

Fmoc-L-4,4'-biphenylalanine199110-64-087 % similar Fmoc-D-tyr-oh112883-29-185 % similar Fmoc-3-(4-pyridyl)-L-alanine169555-95-783 % similar Fmoc-D-4-pyridylalanine205528-30-983 % similar Fmoc-D-tyr(bzl)-oh138775-48-182 % similar O-Benzyl-N-(((9H-fluoren-9-yl)methoxy)carbonyl)-L-tyrosine71989-40-782 % similar Fmoc-bpa-oh117666-96-382 % similar Fmoc-D-4-chlorophe142994-19-282 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Benzyl (2R,3S)-(-)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate100516-54-9 Fmoc-(S)-3-amino-3-phenylpropionic acid209252-15-3 Fmoc-(R)-3-amino-3-phenylpropionic acid220498-02-2

Elsewhere

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