Boc-D-Phg-OH , 98% , 33125-05-2

Synonym(s):
Boc-Phg-OH;Boc-D-Phg-OH;N-α-t.-Boc-D-phenylglycine;N-α-t.-Boc-L-phenylglycine;Boc-D-α-phenylglycine

CAS NO.：33125-05-2

Empirical Formula: C13H17NO4

Molecular Weight: 251.28

MDL number: MFCD00065588

EINECS: 1533716-785-6

PRODUCT Properties

• Melting point: 88-91 °C
• alpha: -142 º (c=1% in ethanol)
• Boiling point: 407.2±38.0 °C(Predicted)
• Density: 1.182±0.06 g/cm3(Predicted)
• refractive index: -140 ° (C=1, EtOH)
• storage temp.: Keep in dark place,Sealed in dry,Room Temperature
• solubility: DMSO, Methanol
• form: Crystalline Powder
• pka: 3.51±0.10(Predicted)
• color: White
• optical activity: [α]20/D 141.0±5.0°, c = 1% in ethanol
• Water Solubility: Insoluble in water. Slightly soluble in DMSO and methanol.
• BRN: 3033982
• InChI: InChI=1S/C13H17NO4/c1-13(2,3)18-12(17)14(9-11(15)16)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,16)
• InChIKey: KIAPYAZGXJCKQL-UHFFFAOYSA-N
• SMILES: C(O)(=O)CN(C(OC(C)(C)C)=O)C1=CC=CC=C1
• CAS DataBase Reference: 33125-05-2(CAS DataBase Reference)

Description and Uses

It is a reagent of choice for assignment of absolute configuration of chiral primary amines by 1H NMR, giving better results than Mosher's acid ((R)-(+)-?-Methoxy-?-(trifluoromethyl)-phenyl-acetic acid. αR)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]-benzeneacetic Acid is D-(+)-2-Phenylglycine with Boc protecting group. (αR)-α-[[(1,1-Dimethylethoxy)carbonyl]amino]-benzeneacetic Acid is used as part of a catalyst combination to catalyze regioselective [4 + 2] cycloadditions of β-substituted cyclic enones and polyconjugated malononitriles. It can also be used to catalyze stereoselective preparation of polyfunctional nitrocyclohexene carboxaldehydes.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362+P364-P403+P233-P501c
• Safety Statements: 24/25
• WGK Germany: 3
• HazardClass: IRRITANT
• HS Code: 29242990