Phenol, 2-bromo-4-fluoro-


Chemical Name: Phenol, 2-bromo-4-fluoro-
CAS Number: 496-69-5
Product Number: AG00335D(AGN-PC-0JTO0N)
Synonyms:
MDL No:
Molecular Formula: C6H4BrFO
Molecular Weight: 190.9978

Identification/Properties


Properties
MP:
43-45 °C
BP:
260.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.554
Computed Properties
Molecular Weight:
190.999g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
189.943g/mol
Monoisotopic Mass:
189.943g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
99.1
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The chemical structure of Phenol, 2-bromo-4-fluoro- (C6H4BrFO) is as follows: ``` Br | H-O-C=C-F | H ``` This structure represents a phenol molecule with a bromine atom attached at the 2-position and a fluorine atom attached at the 4-position.