2,4-Thiophenedicarboxylic acid, 5-amino-3-methyl-, diethyl ester


Chemical Name: 2,4-Thiophenedicarboxylic acid, 5-amino-3-methyl-, diethyl ester
CAS Number: 4815-30-9
Product Number: AG003PG0(AGN-PC-0JLRFH)
Synonyms:
MDL No:
Molecular Formula: C11H15NO4S
Molecular Weight: 257.3061

Identification/Properties


Properties
MP:
105-108 °C(lit.)
BP:
372.6°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5500 (estimate)
Computed Properties
Molecular Weight:
257.304g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
257.072g/mol
Monoisotopic Mass:
257.072g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
297
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:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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