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785777-88-0

785777-88-0 | 5-Bromo-4-(trifluoromethyl)pyrimidine

CAS No: 785777-88-0 Catalog No: AG0038FE MDL No:MFCD11046325

Product Description

Catalog Number:
AG0038FE
Chemical Name:
5-Bromo-4-(trifluoromethyl)pyrimidine
CAS Number:
785777-88-0
Molecular Formula:
C5H2BrF3N2
Molecular Weight:
226.9820
MDL Number:
MFCD11046325
IUPAC Name:
5-bromo-4-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C5H2BrF3N2/c6-3-1-10-2-11-4(3)5(7,8)9/h1-2H
InChI Key:
XQBMNXRFVINPTJ-UHFFFAOYSA-N
SMILES:
Brc1cncnc1C(F)(F)F

Properties

Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.935g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.984g/mol
Monoisotopic Mass:
225.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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