Home Halogens 5-bromo-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine

5-bromo-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine

CAS No.:
956127-82-5
Catalog Number:
AG01B2NZ
Molecular Formula:
C11H7BrF3N3
Molecular Weight:
318.0926
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Product Description
Catalog Number:
AG01B2NZ
Chemical Name:
5-bromo-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine
CAS Number:
956127-82-5
Molecular Formula:
C11H7BrF3N3
Molecular Weight:
318.0926
MDL Number:
MFCD18631307
IUPAC Name:
5-bromo-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine
InChI:
InChI=1S/C11H7BrF3N3/c12-8-5-16-10(17-6-8)18-9-3-1-2-7(4-9)11(13,14)15/h1-6H,(H,16,17,18)
InChI Key:
KHZQJYJQTMDKCS-UHFFFAOYSA-N
SMILES:
Brc1cnc(nc1)Nc1cccc(c1)C(F)(F)F
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.978g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
318.097g/mol
Monoisotopic Mass:
316.978g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties