D-Aspartic acid, N-[(phenylmethoxy)carbonyl]-


Chemical Name: D-Aspartic acid, N-[(phenylmethoxy)carbonyl]-
CAS Number: 78663-07-7
Product Number: AG003C8E(AGN-PC-0OI5VE)
Synonyms:
MDL No: MFCD00063182
Molecular Formula: C12H13NO6
Molecular Weight: 267.2347

Identification/Properties


Properties
MP:
117 °C
BP:
472.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
-10 ° (C=7, AcOH)
Computed Properties
Molecular Weight:
267.237g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Exact Mass:
267.074g/mol
Monoisotopic Mass:
267.074g/mol
Topological Polar Surface Area:
113A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
337
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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