Home Sulfos Phenol, 2-nitro-4-[(trifluoromethyl)sulfonyl]-

Phenol, 2-nitro-4-[(trifluoromethyl)sulfonyl]-

CAS No.:
15183-75-2
Catalog Number:
AG007E09
Molecular Formula:
C7H4F3NO5S
Molecular Weight:
271.1706
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Product Description
Catalog Number:
AG007E09
Chemical Name:
Phenol, 2-nitro-4-[(trifluoromethyl)sulfonyl]-
CAS Number:
15183-75-2
Molecular Formula:
C7H4F3NO5S
Molecular Weight:
271.1706
MDL Number:
MFCD00986405
IUPAC Name:
2-nitro-4-(trifluoromethylsulfonyl)phenol
InChI:
InChI=1S/C7H4F3NO5S/c8-7(9,10)17(15,16)4-1-2-6(12)5(3-4)11(13)14/h1-3,12H
InChI Key:
YIKCQUUQMXHEEU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1O)S(=O)(=O)C(F)(F)F
Properties
Complexity:
395  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.976g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.166g/mol
Monoisotopic Mass:
270.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties