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About This Item
Empirical Formula (Hill Notation):
C13H14N2O
CAS Number:
Molecular Weight:
214.26
NACRES:
NA.24
UNSPSC Code:
41116107
Beilstein/REAXYS Number:
207310
MDL number:
grade
primary reference standard
product line
phyproof® Reference Substance
assay
≥95.0% (HPLC)
manufacturer/tradename
PhytoLab
mp
232-234 °C (lit.)
application(s)
food and beverages
format
neat
SMILES string
COc1ccc2c3CCN=C(C)c3[nH]c2c1
InChI
1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3
InChI key
RERZNCLIYCABFS-UHFFFAOYSA-N
General description
This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
Application
Reactant for preparation of:
Natural product scaffold in preparation of:
- Acylated harmalines via Friedel-Crafts reaction
- Phenacyl derivatives of 1-methyl-7-methoxy-β-carbolines as central nervous system affectors
- Palladium harmaline DMSO chloro complex as anti-tumor agent
Natural product scaffold in preparation of:
- Trypanothione reductase inhibitors†
Biochem/physiol Actions
CNS stimulant; may act through NMDA receptors
Legal Information
phyproof is a registered trademark of PhytoLab GmbH & Co. KG
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - STOT SE 2
target_organs
Central nervous system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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