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Merck
CN

710962

4-Oxo-L-proline hydrobromide

85%

Synonym(s):

(S)-4-Oxopyrrolidine-2-carboxylic acid hydrobromide

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About This Item

Empirical Formula (Hill Notation):
C5H8NO3Br
CAS Number:
Molecular Weight:
210.03
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
Assay:
85%
Form:
solid
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InChI

1S/C5H7NO3.BrH/c7-3-1-4(5(8)9)6-2-3;/h4,6H,1-2H2,(H,8,9);1H/t4-;/m0./s1

SMILES string

Br.OC(=O)[C@@H]1CC(=O)CN1

InChI key

SFSROLZHCPCODJ-WCCKRBBISA-N

assay

85%

form

solid

optical activity

[α]22/D −32.0°, c = 0.5 in methanol

mp

134-140 °C

functional group

carboxylic acid, ketone

storage temp.

2-8°C

Quality Level

Application

4-Oxo-L-proline, a proline derivative, can be used as a site-specific infrared probe, since its C=O stretching vibration is sensitive to the surrounding environment.

pictograms

CorrosionExclamation mark

signalword

Danger

Hazard Classifications

Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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Rachel M Abaskharon et al.
The journal of physical chemistry. B, 123(24), 5079-5085 (2019-05-29)
Due to its unique structure, proline plays important structural and functional roles in proteins. However, this special amino acid lacks an adequate vibrational mode that can be exploited to probe its local electrostatic and hydration status via infrared spectroscopy. Herein

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