Home Other Building Blocks N-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-N'-[4-HYDROXY-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]GUANIDINE

N-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-N'-[4-HYDROXY-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]GUANIDINE

CAS No.:
618092-26-5
Catalog Number:
AG00F931
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00F931
Chemical Name:
N-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-N'-[4-HYDROXY-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]GUANIDINE
CAS Number:
618092-26-5
MDL Number:
MFCD05150373
IUPAC Name:
1-[3,5-bis(trifluoromethyl)phenyl]-2-[6-oxo-4-(trifluoromethyl)-1H-pyrimidin-2-yl]guanidine
InChI:
InChI=1S/C14H8F9N5O/c15-12(16,17)5-1-6(13(18,19)20)3-7(2-5)25-10(24)28-11-26-8(14(21,22)23)4-9(29)27-11/h1-4H,(H4,24,25,26,27,28,29)
InChI Key:
ZXDAKBNIYIBFPN-UHFFFAOYSA-N
Properties
Complexity:
713  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
433.059g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
11  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
433.238g/mol
Monoisotopic Mass:
433.059g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.8  
Properties