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75705-90-7

75705-90-7 | 4-Isoxazolecarboxamide, N,5-dimethyl-N-[4-(trifluoromethyl)phenyl]-

CAS No: 75705-90-7 Catalog No: AG005IU2 MDL No:

Product Description

Catalog Number:
AG005IU2
Chemical Name:
4-Isoxazolecarboxamide, N,5-dimethyl-N-[4-(trifluoromethyl)phenyl]-
CAS Number:
75705-90-7
Molecular Formula:
C13H11F3N2O2
Molecular Weight:
284.2338
IUPAC Name:
N,5-dimethyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C13H11F3N2O2/c1-8-11(7-17-20-8)12(19)18(2)10-5-3-9(4-6-10)13(14,15)16/h3-7H,1-2H3
InChI Key:
LTEWFCGMBBSZKO-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1cnoc1C)c1ccc(cc1)C(F)(F)F

Properties

Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.077g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.238g/mol
Monoisotopic Mass:
284.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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