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46022-05-3

Name (1R,2R)-(-)-1,2-CYCLOHEXANEDICARBOXYLIC ACID
CAS 46022-05-3
EINECS(EC#) 670-321-4
Molecular Formula C8H12O4
MDL Number MFCD00062973
Molecular Weight 172.18
MOL File 46022-05-3.mol
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Chemical Properties

Melting point  184 °C
Boiling point  384.1±35.0 °C(Predicted)
density  1.314±0.06 g/cm3(Predicted)
refractive index  -18 ° (C=1, Acetone)
storage temp.  Store below +30°C.
solubility  Soluble in acetone.
form  Solid
pka 4.18±0.28(Predicted)
color  White to Off-White
InChI InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6-/m1/s1
InChIKey QSAWQNUELGIYBC-PHDIDXHHSA-N
SMILES [C@@H]1(C(O)=O)CCCC[C@H]1C(O)=O
CAS DataBase Reference 46022-05-3(CAS DataBase Reference)
EPA Substance Registry System 1,2-Cyclohexanedicarboxylic acid, (1R,2R)- (46022-05-3)

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  WGK 3 highly water endangering
HS Code  29171900

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