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Chemical structure of Boc-3,4-difluoro-L-phenylalanine

GC66180

Boc-3,4-difluoro-L-phenylalanine

Also listed as (2S)-2-[(tert-Butoxycarbonyl)amino]-3-(3,4-difluorophenyl)propionic acid

(2S)-2-[(tert-Butoxycarbonyl)amino]-3-(3,4-difluorophenyl)propionic acid is a phenylalanine derivative

ChemicalCAS198474-90-7MW301.29FormulaC14H17F2NO4
CAS number
198474-90-7
Molecular weight
301.29
Formula
C14H17F2NO4
Solubility
DMSO ： ≥ 100 mg/mL (331·91 mM)
InChIKey
CYAOPVHXASZUDE-NSHDSACASA-N
Catalogue number
GC66180
Brand
GLPBIO
Computed properties PubChem CID 7020829 · XLogP 2.7 · TPSA 75.6 Ų · H-bond donors 2
XLogP
2.7
TPSA
75.6 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
21

SMILES CC(C)(C)OC(=O)N[C@@H](CC1=CC(=C(C=C1)F)F)C(=O)O

Computed descriptors from PubChem (CID 7020829), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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