A-3 hydrochloride Structure

A-3 hydrochloride

Chemical Properties

Melting point 173-176°C
storage temp.  -20°C
solubility  DMSO: 24 mg/mL
form  solid
color  white
InChI 1S/C12H13ClN2O2S.ClH/c13-11-5-1-4-10-9(11)3-2-6-12(10)18(16,17)15-8-7-14;/h1-6,15H,7-8,14H2;1H
InChIKey VWAGIWCLJAQLAL-UHFFFAOYSA-N
SMILES Cl[H].NCCNS(=O)(=O)c1cccc2c(Cl)cccc12
UNSPSC Code 12352200
NACRES NA.77

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HS Code  2935909099
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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A-3 hydrochloride Spectrum