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D-(+)-NEOPTERIN Structure

D-(+)-NEOPTERIN

Chemical Properties

Melting point >232°C (dec.)
alpha  D25 +45 ± 3° (c = 0.3 in 0.1N HCl)
Boiling point 396.41°C (rough estimate)
Density  1.3957 (rough estimate)
refractive index  1.7610 (estimate)
storage temp.  2-8°C
solubility  Aqueous Acid (Slightly, Sonicated), Aqueous Base (Slightly)
form  Off-white to yellow solid.
pka 12.60±0.20(Predicted)
color  Light Orange to Light Brown
Merck  13,6490
BRN  89070
Stability Hygroscopic
InChI InChI=1S/C9H11N5O4/c10-9-13-7-5(8(18)14-9)12-3(1-11-7)6(17)4(16)2-15/h1,4,6,15-17H,2H2,(H3,10,11,13,14,18)/t4-,6+/m1/s1
InChIKey BMQYVXCPAOLZOK-XINAWCOVSA-N
SMILES N1C2C(=NC([C@H](O)[C@H](O)CO)=CN=2)C(=O)NC=1N

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26
WGK Germany  3
F  23
HS Code  29335990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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