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About This Item
Empirical Formula (Hill Notation):
C9H9NS
CAS Number:
Molecular Weight:
163.24
PubChem Substance ID:
UNSPSC Code:
12352200
Beilstein/REAXYS Number:
6476424
MDL number:
assay
≥99.0%, ≥99.0% (sum of enantiomers, GC)
SMILES string
C[C@@H](N=C=S)c1ccccc1
InChI
1S/C9H9NS/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3/t8-/m1/s1
InChI key
QQCJPTVZIZVKEZ-MRVPVSSYSA-N
grade
derivatization grade ((chiral))
optical purity
enantiomeric ratio: ≥97:3 (GC)
color
very deep yellow
storage temp.
2-8°C
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Other Notes
Derivatizing agent for HPLC; assay of enantiomeric purity of amines
signalword
Danger
hcodes
Hazard Classifications
Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
150.8 °F - closed cup
flash_point_c
66 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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J. Gal, A.J. Sedman
Journal of Chromatography A, 314, 275-275 (1984)
D.J. Jeon et al.
Chemistry Letters (Jpn), 40-40 (2000)
J Gal et al.
Chirality, 2(1), 43-51 (1990-01-01)
The search for new antiarrhythmic agents has been intense, because the established drugs for the treatment of cardiac arrhythmias are neither uniformly effective nor well-tolerated. Among the recently introduced new antiarrhythmic agents are tocainide (TOC), mexiletine (MEX), flecainide (FLE), and
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