Home Sulfos Ethanone,2,2,2-trifluoro-1-(4-methylphenyl)-, O-[(4-methylphenyl)sulfonyl]oxime

Ethanone,2,2,2-trifluoro-1-(4-methylphenyl)-, O-[(4-methylphenyl)sulfonyl]oxime

CAS No.:
87736-79-6
Catalog Number:
AG004G7I
Molecular Formula:
C16H14F3NO3S
Molecular Weight:
357.3475
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Product Description
Catalog Number:
AG004G7I
Chemical Name:
Ethanone,2,2,2-trifluoro-1-(4-methylphenyl)-, O-[(4-methylphenyl)sulfonyl]oxime
CAS Number:
87736-79-6
Molecular Formula:
C16H14F3NO3S
Molecular Weight:
357.3475
MDL Number:
MFCD10566024
IUPAC Name:
[[2,2,2-trifluoro-1-(4-methylphenyl)ethylidene]amino] 4-methylbenzenesulfonate
InChI:
InChI=1S/C16H14F3NO3S/c1-11-3-7-13(8-4-11)15(16(17,18)19)20-23-24(21,22)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChI Key:
GHAOMANCFBUXTJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=NOS(=O)(=O)c1ccc(cc1)C)C(F)(F)F
Properties
Complexity:
538  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.065g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.347g/mol
Monoisotopic Mass:
357.065g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.2  
Properties