Thieno[3,2-d]pyrimidin-4(3H)-one,7-bromo-


Chemical Name: Thieno[3,2-d]pyrimidin-4(3H)-one,7-bromo-
CAS Number: 31169-25-2
Product Number: AG003NE0(AGN-PC-0R6HBC)
Synonyms:
MDL No: MFCD11518998
Molecular Formula: C6H3BrN2OS
Molecular Weight: 231.0698

Identification/Properties


Properties
MP:
330°C
BP:
452.7°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
231.067g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
229.915g/mol
Monoisotopic Mass:
229.915g/mol
Topological Polar Surface Area:
69.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
221
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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