1457-59-6

Name 5-methyl-1H-4-carboxylic acid
CAS 1457-59-6
EINECS(EC#) 215-944-0
Molecular Formula C5H6N2O2
MDL Number MFCD00233368
Molecular Weight 126.11
MOL File 1457-59-6.mol
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Chemical Properties

Boiling point  458.2±25.0 °C(Predicted)
density  1.404±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Aqueous Base (Slightly), DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 2.36±0.31(Predicted)
color  Pale Brown to Brown
Stability: Hygroscopic
InChI 1S/C5H6N2O2/c1-3-4(5(8)9)7-2-6-3/h2H,1H3,(H,6,7)(H,8,9)
InChIKey ULHLTDXPKWELHQ-UHFFFAOYSA-N
SMILES Cc1nc[nH]c1C(O)=O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

Spectrum Detail

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