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Home > Fluorides > 1269292-51-4
1269292-51-4 | 2,4'-Bipyrimidine, 2'-(trifluoromethyl)-
CAS No: 1269292-51-4 Catalog No: AG000TJ8 MDL No:
Product Description
Catalog Number:
AG000TJ8
Chemical Name:
2,4'-Bipyrimidine, 2'-(trifluoromethyl)-
CAS Number:
1269292-51-4
Molecular Formula:
C9H5F3N4
Molecular Weight:
226.1580
IUPAC Name:
4-pyrimidin-2-yl-2-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C9H5F3N4/c10-9(11,12)8-15-5-2-6(16-8)7-13-3-1-4-14-7/h1-5H
InChI Key:
SWQLOTHZQWFOQR-UHFFFAOYSA-N
SMILES:
FC(c1nccc(n1)c1ncccn1)(F)F
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.047g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.162g/mol
Monoisotopic Mass:
226.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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