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204255-17-4

204255-17-4 | Pyrimidine, 5-bromo-2,4-dimethoxy-6-(trifluoromethyl)-

CAS No: 204255-17-4 Catalog No: AG0029D3 MDL No:

Product Description

Catalog Number:
AG0029D3
Chemical Name:
Pyrimidine, 5-bromo-2,4-dimethoxy-6-(trifluoromethyl)-
CAS Number:
204255-17-4
Molecular Formula:
C7H6BrF3N2O2
Molecular Weight:
287.0339
IUPAC Name:
5-bromo-2,4-dimethoxy-6-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C7H6BrF3N2O2/c1-14-5-3(8)4(7(9,10)11)12-6(13-5)15-2/h1-2H3
InChI Key:
CQNNWBZRYWOCQV-UHFFFAOYSA-N
SMILES:
COc1nc(OC)c(c(n1)C(F)(F)F)Br

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.956g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.036g/mol
Monoisotopic Mass:
285.956g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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