Benzene, 1-fluoro-3-(trifluoromethyl)-


Chemical Name: Benzene, 1-fluoro-3-(trifluoromethyl)-
CAS Number: 401-80-9
Product Number: AG0033PK(AGN-PC-0JL83L)
Synonyms:
MDL No:
Molecular Formula: C7H4F4
Molecular Weight: 164.1003

Identification/Properties


Properties
MP:
-81.5°C
BP:
103.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.4(lit.)
Computed Properties
Molecular Weight:
164.103g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
164.025g/mol
Monoisotopic Mass:
164.025g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
129
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:
Danger
UN#:
1993
Hazard Statements:
H225-H315-H319-H335
Precautionary Statements:
P210-P261-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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