Melting point |
145-148 °C (lit.) |
alpha |
58 º (c=1, MeOH) |
Boiling point |
367.5±17.0 °C(Predicted) |
Density |
1.302±0.06 g/cm3(Predicted) |
refractive index |
38 ° (C=0.1, MeOH) |
storage temp. |
Inert atmosphere,Room Temperature |
solubility |
DMSO (Slightly), Methanol (Slightly) |
form |
Solid |
pka |
3.32±0.10(Predicted) |
color |
Off-White |
optical activity |
[α]20/D +58°, c = 1 in methanol |
InChI |
InChI=1S/C9H10O4/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6,10H,1H3,(H,11,12)/t6-/m1/s1 |
InChIKey |
AQIHDXGKQHFBNW-ZCFIWIBFSA-N |
SMILES |
C(O)(=O)[C@H](OC1=CC=C(O)C=C1)C |
CAS DataBase Reference |
94050-90-5(CAS DataBase Reference) |