Allylmalonic acid Structure

Allylmalonic acid

Chemical Properties

Melting point 102-105 °C
Boiling point 182.71°C (rough estimate)
Density  1.1311 (rough estimate)
refractive index  1.4434 (estimate)
storage temp.  2-8°C
form  powder
pka 2.85±0.34(Predicted)
BRN  1766382
InChI 1S/C6H8O4/c1-2-3-4(5(7)8)6(9)10/h2,4H,1,3H2,(H,7,8)(H,9,10)
InChIKey ZDZVKPXKLLLOOA-UHFFFAOYSA-N
SMILES OC(=O)C(CC=C)C(O)=O
CAS DataBase Reference 2583-25-7(CAS DataBase Reference)
FDA UNII 59UX4PT5LH
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements 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
NFPA 704:
0
2 0

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