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About This Item
Empirical Formula (Hill Notation):
C12H16N2O2
CAS Number:
Molecular Weight:
220.27
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
179500
Assay:
98%
InChI
1S/C12H16N2O2/c15-12(14-8-6-13-7-9-14)16-10-11-4-2-1-3-5-11/h1-5,13H,6-10H2
SMILES string
O=C(OCc1ccccc1)N2CCNCC2
InChI key
CTOUWUYDDUSBQE-UHFFFAOYSA-N
assay
98%
refractive index
n20/D 1.546 (lit.)
bp
158-161 °C/1.4 mmHg (lit.)
density
1.142 g/mL at 25 °C (lit.)
functional group
phenyl
Quality Level
Related Categories
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
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Dai Nozawa et al.
Bioorganic & medicinal chemistry, 15(6), 2375-2385 (2007-02-03)
In the present study, we found that a novel piperazine compound, 11a, showed a moderate affinity (IC(50)=333nM) for the MC4 receptor. We developed the new type of piperazine compounds and found that mono-piperazine 11b exhibited a high-affinity (IC(50)=40.3nM) for the
Synthesis of Macrocyclic, Triazine-Based Receptor Molecules.
Lowik DWPM and Lowe CR.
European Journal of Organic Chemistry, 2001(15), 2825-2839 (2001)
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