687340
N-Boc-4,4-difluoro-L-proline
97%
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About This Item
Empirical Formula (Hill Notation):
C10H15F2NO4
CAS Number:
Molecular Weight:
251.23
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
Product Name
N-Boc-4,4-difluoro-L-proline, 97%
InChI
1S/C10H15F2NO4/c1-9(2,3)17-8(16)13-5-10(11,12)4-6(13)7(14)15/h6H,4-5H2,1-3H3,(H,14,15)/t6-/m0/s1
SMILES string
CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(O)=O
InChI key
WTMZYKCXBXPVPT-LURJTMIESA-N
assay
97%
form
solid
optical activity
[α]22/D -69.0° in chloroform
mp
120-124 °C
functional group
carboxylic acid
fluoro
Quality Level
Application
N-Boc-4,4-difluoro-L-proline can be used as a substrate in the preparation of possible dipeptidyl peptidase I (DPPI) inhibitors and VLA-4 antagonists.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - 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
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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4-(Pyrrolidinyl) methoxybenzoic acid derivatives as a potent, orally active VLA-4 antagonist
Chiba J, et al.
Chemical & Pharmaceutical Bulletin, 54(11), 1515-1529 (2006)
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