3-Piperidinecarboxylic acid, ethyl ester, (3R)-,(2S,3S)-2,3-dihydroxybutanedioate (1:1)


Chemical Name: 3-Piperidinecarboxylic acid, ethyl ester, (3R)-,(2S,3S)-2,3-dihydroxybutanedioate (1:1)
CAS Number: 167392-57-6
Product Number: AG001XCO(AGN-PC-0Q91X4)
Synonyms:
MDL No: MFCD00799538
Molecular Formula: C12H21NO8
Molecular Weight: 307.2970

Identification/Properties


Properties
MP:
157-159 °C(lit.)
BP:
504.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
10.3 ° (C=5, H2O)
Computed Properties
Molecular Weight:
307.299g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
6
Exact Mass:
307.127g/mol
Monoisotopic Mass:
307.127g/mol
Topological Polar Surface Area:
153A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
270
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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