73611

4-Nitro-D-phenylalanine hydrate

≥99.0% (TLC), ~1 mol/mol water

• Empirical Formula (Hill Notation): C₉H₁₀N₂O₄ · xH₂O
• CAS Number: 56613-61-7
• Molecular Weight: 210.19 (anhydrous basis)
• Beilstein/REAXYS Number: 3205966
• MDL number: MFCD00150962
• UNSPSC Code: 12352200
• PubChem Substance ID: 57652485
• NACRES: NA.22

Properties

• assay: ≥99.0% (TLC)
• form: crystals
• optical activity: [α]20/D −7.0±1°, c = 2% in 1 M HCl
• reaction suitability: reaction type: solution phase peptide synthesis
• impurities: ~1 mol/mol water
• application(s): peptide synthesis
• SMILES string: O.N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(O)=O
• InChI: 1S/C9H10N2O4.H2O/c10-8(9(12)13)5-6-1-3-7(4-2-6)11(14)15;/h1-4,8H,5,10H2,(H,12,13);1H2/t8-;/m1./s1
• InChI key: OLZDHJRNUIXKLU-DDWIOCJRSA-N

Safety Information

• Storage Class: 13 - Non Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)