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


Chemical Name: Benzoic acid, 3-amino-4-methoxy-, methyl ester
CAS Number: 24812-90-6
Product Number: AG002PJN(AGN-PC-0KK6R7)
Synonyms:
MDL No: MFCD00017196
Molecular Formula: C9H11NO3
Molecular Weight: 181.1885

Identification/Properties


Properties
MP:
84-86 °C
BP:
325.9°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
181.191g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
181.074g/mol
Monoisotopic Mass:
181.074g/mol
Topological Polar Surface Area:
61.6A^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


NMR Spectrum


Other Analytical Data


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