1,3,5-Triazin-2(1H)-one, 4,6-dimethoxy-


Chemical Name: 1,3,5-Triazin-2(1H)-one, 4,6-dimethoxy-
CAS Number: 1075-59-8
Product Number: AG0033VJ(AGN-PC-0JKBJV)
Synonyms:
MDL No:
Molecular Formula: C5H7N3O3
Molecular Weight: 157.1274

Identification/Properties


Properties
MP:
147 - 150°C
BP:
185.2±23.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
157.129g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
157.049g/mol
Monoisotopic Mass:
157.049g/mol
Topological Polar Surface Area:
72.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
233
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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