1,2,3-Trifluoro-4-nitrobenzene


Chemical Name: 1,2,3-Trifluoro-4-nitrobenzene
CAS Number: 771-69-7
Product Number: AG003AZM(AGN-PC-0WA41V)
Synonyms:
MDL No:
Molecular Formula: C6H2F3NO2
Molecular Weight: 177.0808

Identification/Properties


Properties
BP:
92°C at 20 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.492(lit.)
Computed Properties
Molecular Weight:
177.082g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
177.004g/mol
Monoisotopic Mass:
177.004g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
184
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+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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