R(+)-IAA-94

Chemical Properties

Boiling point	537.2±50.0 °C(Predicted)
Density	1.401±0.06 g/cm3(Predicted)
storage temp.	2-8°C
solubility	H₂O: 0.2 mg/mL
pka	2.80±0.10(Predicted)
form	solid
color	white
optical activity	[α]22/D +36.4°, c = 0.86 in methanol(lit.)
Water Solubility	H2O: 0.2mg/mL 0.1 M NaOH: 2.8mg/mL DMSO: >20mg/mL ethanol: 20mg/mL dilute aqueous acid: insoluble
InChI	InChI=1S/C17H18Cl2O4/c1-17(10-4-2-3-5-10)7-9-6-11(23-8-12(20)21)14(18)15(19)13(9)16(17)22/h6,10H,2-5,7-8H2,1H3,(H,20,21)/t17-/m1/s1
InChIKey	RNOJGTHBMJBOSP-QGZVFWFLSA-N
SMILES	C(O)(=O)COC1C(Cl)=C(Cl)C2=C(C=1)C[C@@](C1CCCC1)(C)C2=O

WGK Germany	3
Storage Class	11 - Combustible Solids