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460720-14-3

Name (αS)-Cyclohexanebutanoic Acid α-[[(1S)-1-Carboxyethyl]aMino] cyclohexanebutanoic Acid α-Ethyl Ester
CAS 460720-14-3
Molecular Formula C15H27NO4
MDL Number MFCD30719917
Molecular Weight 285.38
MOL File 460720-14-3.mol
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Chemical Properties

Melting point  >152°C (dec.)
Boiling point  412.1±30.0 °C(Predicted)
density  1.067±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  Ethanol (Slightly), Methanol (Slightly)
form  Solid
pka 2.15±0.10(Predicted)
color  White
InChI 1S/C15H27NO4/c1-3-20-15(19)13(16-11(2)14(17)18)10-9-12-7-5-4-6-8-12/h11-13,16H,3-10H2,1-2H3,(H,17,18)/t11-,13-/m0/s1
InChIKey SSKKXRIKYHEFTJ-AAEUAGOBSA-N
SMILES [N+H2]([C@@H](CCC1CCCCC1)C(=O)OCC)[C@@H](C)C(=O)[O-]

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H335-H315-H319
Precautionary statements  P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Storage Class 11 - Combustible Solids

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