5-(3-Nitro-phenyl)-furan-2-carboxylic acid Structure

5-(3-Nitro-phenyl)-furan-2-carboxylic acid

Chemical Properties

Melting point 252-260 °C(lit.)
Boiling point 450.2±40.0 °C(Predicted)
Density  1.440±0.06 g/cm3(Predicted)
pka 2.88±0.10(Predicted)
InChI 1S/C11H7NO5/c13-11(14)10-5-4-9(17-10)7-2-1-3-8(6-7)12(15)16/h1-6H,(H,13,14)
InChIKey XWQLGLUTQIKSAJ-UHFFFAOYSA-N
SMILES OC(=O)c1ccc(o1)-c2cccc(c2)[N+]([O-])=O
CAS DataBase Reference 13130-13-7(CAS DataBase Reference)
UNSPSC Code 12352100
NACRES NA.22

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
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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5-(3-Nitro-phenyl)-furan-2-carboxylic acid Spectrum