Phenol, 2-amino-5-nitro-4-(trifluoromethyl)-


Chemical Name: Phenol, 2-amino-5-nitro-4-(trifluoromethyl)-
CAS Number: 56987-02-1
Product Number: AG00EFAS(AGN-PC-07Y49Y)
Synonyms:
MDL No:
Molecular Formula: C7H5F3N2O3
Molecular Weight: 222.1214

Identification/Properties


Computed Properties
Molecular Weight:
222.123g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
0
Exact Mass:
222.025g/mol
Monoisotopic Mass:
222.025g/mol
Topological Polar Surface Area:
92.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
253
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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