6236-10-8

Name (R)-(-)-CITRAMALIC ACID
CAS 6236-10-8
Molecular Formula C5H8O5
MDL Number MFCD00066438
Molecular Weight 148.11
MOL File 6236-10-8.mol
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Chemical Properties

Appearance white fine crystalline powder
Melting point  108-110 °C(lit.)
Boiling point  188.68°C (rough estimate)
density  1.2336 (rough estimate)
refractive index  1.3920 (estimate)
storage temp.  2-8°C
solubility  PBS (pH 7.2): 10 mg/ml
form  powder or crystals
pka 3.65±0.28(Predicted)
Optical Rotation [α]/D -19.0±1.0°, c = 0.5 in 1 M HCl
Merck  2323
BRN  1723818
InChI 1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)/t5-/m1/s1
InChIKey XFTRTWQBIOMVPK-RXMQYKEDSA-N
SMILES C[C@@](O)(CC(O)=O)C(O)=O || C[C@@](O)(CC(O)=O)C(O)=O
CAS DataBase Reference 6236-10-8(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
F  3-10
Storage Class 11 - Combustible Solids

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