Benzoic acid, 2,6-difluoro-3-iodo-, methyl ester


Chemical Name: Benzoic acid, 2,6-difluoro-3-iodo-, methyl ester
CAS Number: 501433-14-3
Product Number: AG003RLZ(AGN-PC-0C4CQB)
Synonyms:
MDL No: MFCD22573793
Molecular Formula: C8H5F2IO2
Molecular Weight: 298.0254

Identification/Properties


Properties
BP:
300.2±42.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
298.027g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
297.93g/mol
Monoisotopic Mass:
297.93g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
201
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#:
-
Hazard Statements:
H302-H315-H320-H335
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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