Benzoic acid, 2-amino-4-iodo-


Chemical Name: Benzoic acid, 2-amino-4-iodo-
CAS Number: 20776-54-9
Product Number: AG002J9I(AGN-PC-03TVNG)
Synonyms:
MDL No: MFCD09800365
Molecular Formula: C7H6INO2
Molecular Weight: 263.0325

Identification/Properties


Properties
MP:
208℃ (decomp)(Solv: ethanol (64-17-5))
BP:
377°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
263.034g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
262.944g/mol
Monoisotopic Mass:
262.944g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
163
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:
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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