560-09-8

Name (1S,3R)-1,2,2-TRIMETHYL-1,3-CYCLOPENTANEDICARBOXYLIC ACID
CAS 560-09-8
EINECS(EC#) 200-258-5
Molecular Formula C10H16O4
MDL Number MFCD00064937
Molecular Weight 200.23
MOL File 560-09-8.mol
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Chemical Properties

Melting point  188-190 °C(lit.)
Boiling point  312.0±25.0 °C(Predicted)
density  1.177±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  DMSO, Ethanol, Methanol
form  Solid
pka 4.57±0.60(Predicted)
color  White to Off-White
Optical Rotation [α]20/D 48°, c = 10 in ethanol
BRN  1874674
InChI 1S/C10H16O4/c1-9(2)6(7(11)12)4-5-10(9,3)8(13)14/h6H,4-5H2,1-3H3,(H,11,12)(H,13,14)/t6-,10+/m0/s1
InChIKey LSPHULWDVZXLIL-QUBYGPBYSA-N
SMILES CC1(C)[C@@H](CC[C@]1(C)C(O)=O)C(O)=O
CAS DataBase Reference 560-09-8(CAS DataBase Reference)

Safety Data

Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
HS Code  29172090
Storage Class 11 - Combustible Solids

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Spectrum Detail

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