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About This Item
Empirical Formula (Hill Notation):
C21H22ClNO4
CAS Number:
Molecular Weight:
387.86
UNSPSC Code:
41116107
NACRES:
NA.24
MDL number:
grade
primary reference standard
product line
phyproof® Reference Substance
assay
≥95.0% (HPLC)
manufacturer/tradename
PhytoLab
application(s)
food and beverages
format
neat
SMILES string
COC1=CC2=C(C=C1OC)CC[N+]3=CC4=C(OC)C(OC)=CC=C4C=C32.[Cl-]
InChI
1S/C21H22NO4.ClH/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4;/h5-6,9-12H,7-8H2,1-4H3;1H/q+1;/p-1
InChI key
RLQYRXCUPVKSAW-UHFFFAOYSA-M
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
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
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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