L-xylo-2-Hexulosonic acid, methyl ester


Chemical Name: L-xylo-2-Hexulosonic acid, methyl ester
CAS Number: 3031-98-9
Product Number: AG002ZMG(AGN-PC-0O8QRS)
Synonyms:
MDL No:
Molecular Formula: C7H12O7
Molecular Weight: 208.1660

Identification/Properties


Properties
MP:
158-159℃
BP:
495.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
208.166g/mol
XLogP3:
-2.5
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
6
Exact Mass:
208.058g/mol
Monoisotopic Mass:
208.058g/mol
Topological Polar Surface Area:
124A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
214
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H319-H317
Precautionary Statements:
P305+P351+P338-P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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