Benzoic acid, 3-iodo-4-methoxy-, methyl ester


Chemical Name: Benzoic acid, 3-iodo-4-methoxy-, methyl ester
CAS Number: 35387-93-0
Product Number: AG00BZJ4(AGN-PC-0JOWK4)
Synonyms:
MDL No: MFCD00052925
Molecular Formula: C9H9IO3
Molecular Weight: 292.0704

Identification/Properties


Properties
MP:
93-95 °C
BP:
340.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Light Sensitive
Computed Properties
Molecular Weight:
292.072g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
291.96g/mol
Monoisotopic Mass:
291.96g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
184
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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