Pyrimidine,1,4,5,6-tetrahydro-1-methyl-2-[(2E)-2-(3-methyl-2-thienyl)ethenyl]-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)


Chemical Name: Pyrimidine,1,4,5,6-tetrahydro-1-methyl-2-[(2E)-2-(3-methyl-2-thienyl)ethenyl]-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)
CAS Number: 26155-31-7
Product Number: AG002RVO(AGN-PC-0R22H4)
Synonyms:
MDL No:
Molecular Formula: C16H22N2O6S
Molecular Weight: 370.4207

Identification/Properties


Properties
MP:
164 - 168°C
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
370.42g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
5
Exact Mass:
370.12g/mol
Monoisotopic Mass:
370.12g/mol
Topological Polar Surface Area:
159A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
407
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H332
Precautionary Statements:
P261-P301+P312+P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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