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About This Item
Empirical Formula (Hill Notation):
C13H23NO4
CAS Number:
Molecular Weight:
257.33
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
InChI key
MYHJCTUTPIKNAT-UHFFFAOYSA-N
SMILES string
CCOC(=O)C1CCN(CC1)C(=O)OC(C)(C)C
InChI
1S/C13H23NO4/c1-5-17-11(15)10-6-8-14(9-7-10)12(16)18-13(2,3)4/h10H,5-9H2,1-4H3
assay
97%
refractive index
n20/D 1.458
bp
120-135 °C/0.5 mmHg
density
1.046 g/mL at 25 °C
functional group
ester
Quality Level
Related Categories
Application
Substrate used in a palladium-catalyzed α-arylation of esters with heterocyclic bromides and chlorides leading to, for example, 4-pyridylpiperidinyl esters.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
>230.0 °F - closed cup
flash_point_c
> 110 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Tetrahedron Letters, 48, 1191-1191 (2007)
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