4-BROMO-5-FLUORO-2-IODOTOLUENE


Chemical Name: 4-BROMO-5-FLUORO-2-IODOTOLUENE
CAS Number: 870704-15-7
Product Number: AG003KYW(AGN-PC-0KL1WN)
Synonyms:
MDL No:
Molecular Formula: C7H5BrFI
Molecular Weight: 314.9215

Identification/Properties


Properties
BP:
249-250 °C(lit.)
Storage:
2-8℃;
Refractive Index:
n20/D 1.624(lit.)
Computed Properties
Molecular Weight:
314.924g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
313.86g/mol
Monoisotopic Mass:
313.86g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
120
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-H413
Precautionary Statements:
P264-P270-P273-P301+P312-P330
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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