ChemicalBook--->CAS DataBase List--->3601-66-9

3601-66-9

3601-66-9 Structure

3601-66-9 Structure
IdentificationMore
[Name]

TERT-BUTOXYCARBONYLAMINO-PHENYL-ACETIC ACID
[CAS]

3601-66-9
[Synonyms]

BOC-DL-(PHENYL)GLY-OH
BOC-DL-PHG-OH
N-ALPHA-T-BUTOXYCARBONYL-DL-PHENYLGLYCINE
N-TERT-BUTOXYCARBONYL-DL-PHENYLGLYCINE
RARECHEM AK ML 0503
TERT-BUTOXYCARBONYLAMINO-PHENYL-ACETIC ACID
N-BOC-DL-PHENYLGLYCINE
[EINECS(EC#)]

1533716-785-6
[Molecular Formula]

C13H17NO4
[MDL Number]

MFCD00971063
[Molecular Weight]

251.28
[MOL File]

3601-66-9.mol
Chemical PropertiesBack Directory
[Melting point ]

111-112℃
[Boiling point ]

407.2±38.0 °C(Predicted)
[density ]

1.182±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

Solid
[pka]

3.51±0.10(Predicted)
[color ]

White to off-white
[Optical Rotation]

Consistent with structure
[CAS DataBase Reference]

3601-66-9(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Flame (GHS02)
GHS07,GHS02
[Signal word ]

Danger
[Hazard statements ]

H315-H319-H225
[Precautionary statements ]

P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P403+P235
Hazard InformationBack Directory
[Uses]

Boc-DL-Phg-OH is a Glycine (HY-Y0966) derivative[1].
[Synthesis]

Di-tert-butyl dicarbonate

24424-99-5

2-Amino-2-phenylacetic acid

2835-06-5

BOC-D-PHG-OH

2900-27-8

General procedure for the synthesis of BOC-L-phenylglycine from di-tert-butyl dicarbonate and 2-amino-2-phenylacetic acid: DL-2-phenylglycine (5.0 g, 33 mmol) was dissolved in 1 N NaOH solution (132 mL). Subsequently, di-tert-butyl dicarbonate (19.0 mL, 82.7 mmol) was added and the reaction mixture was stirred at room temperature until the reaction was complete. N-tert-butoxycarbonyl-DL-phenylglycine was isolated as a white solid (7.61 g, 92% yield) by appropriate post-processing steps.

[References]

[1] Luckose F, et al. Effects of amino acid derivatives on physical, mental, and physiological activities. Crit Rev Food Sci Nutr. 2015;55(13):1793-1144. DOI:10.1080/10408398.2012.708368
Spectrum DetailBack Directory
[Spectrum Detail]

TERT-BUTOXYCARBONYLAMINO-PHENYL-ACETIC ACID(3601-66-9)1HNMR
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