Melting point |
78-80 °C(lit.) |
Boiling point |
277.83°C (rough estimate) |
Density |
1.0160 (rough estimate) |
refractive index |
-26 ° (C=2, 1 %NaOH) |
storage temp. |
Sealed in dry,Room Temperature |
solubility |
Aqueous Base (Slightly), DMSO (Sparingly), Water (Slightly) |
pka |
3.86±0.21(Predicted) |
form |
Solid |
color |
White to Off-White |
optical activity |
[α]22/D 26.3°, c = 1 in 1 M NaOH |
Water Solubility |
almost transparency |
InChI |
InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t5-/m0/s1 |
InChIKey |
LVRFTAZAXQPQHI-YFKPBYRVSA-N |
SMILES |
C(O)(=O)[C@@H](O)CC(C)C |
LogP |
0.710 |
CAS DataBase Reference |
13748-90-8(CAS DataBase Reference) |
EPA Substance Registry System |
Pentanoic acid, 2-hydroxy-4-methyl-, (2S)- (13748-90-8) |