1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate

CAS NO.：203866-14-2
Empirical Formula: C10H16FNO4
Molecular Weight: 233.24
MDL number: MFCD06796085
SAFETY DATA SHEET (SDS)
Update Date: 2023-04-27 16:27:43

What is 1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate?

Chemical properties

White powder

The Uses of 1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate

N-Boc-trans-4-fluoro-L-proline is a useful synthetic intermediate. It is used to prepare potent 3- or 4-substituted-2-cyanopyrrolidine dipeptidyl peptidase IV inhibitors. It is also used to synthesize pyrrolotriazines derivatives as pan-Aurora kinase inhibitors and anti-tumor agents.

What are the applications of Application

N-Boc-trans-4-fluoro-L-proline is a useful boc protected chiral building block for chemical synthesis

Properties of 1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate

Melting point:	115-119°C
Boiling point:	346.0±42.0 °C(Predicted)
Density	1.24±0.1 g/cm3(Predicted)
refractive index	-69 ° (C=1, MeOH)
storage temp.	Inert atmosphere,Room Temperature
solubility	soluble in Methanol
form	powder to crystal
pka	3.53±0.40(Predicted)
color	White to Almost white
optical activity	[α]22/D -65.0±5°, c = 1 in chloroform
CAS DataBase Reference	203866-14-2(CAS DataBase Reference)

Safety information for 1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate

Signal word	Warning
Pictogram(s)	Exclamation Mark Irritant GHS07
GHS Hazard Statements	H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes	P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 1-(1,1-Dimethylethyl) (2S,4R)-4-fluoro-1,2-pyrrolidinedicarboxylate

InChIKey

YGWZXQOYEBWUTH-RQJHMYQMSA-N

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