2-Thiophenecarboxylic acid, 3-amino-, methyl ester


Chemical Name: 2-Thiophenecarboxylic acid, 3-amino-, methyl ester
CAS Number: 22288-78-4
Product Number: AG00356J(AGN-PC-0C4FSO)
Synonyms:
MDL No: MFCD00009765
Molecular Formula: C6H7NO2S
Molecular Weight: 157.1903

Identification/Properties


Properties
MP:
62-64 °C(lit.)
BP:
334.6°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5500 (estimate)
Computed Properties
Molecular Weight:
157.187g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
157.02g/mol
Monoisotopic Mass:
157.02g/mol
Topological Polar Surface Area:
80.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
140
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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