methyl 5-amino-4-cyano-3-(2-methoxy-2-oxoethyl)thiophene-2-carboxylate


Chemical Name: methyl 5-amino-4-cyano-3-(2-methoxy-2-oxoethyl)thiophene-2-carboxylate
CAS Number: 674773-12-7
Product Number: AG006GR9(AGN-PC-0LK94H)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O4S
Molecular Weight: 254.2624

Identification/Properties


Properties
MP:
>138°C (dec.)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
254.26g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
5
Exact Mass:
254.036g/mol
Monoisotopic Mass:
254.036g/mol
Topological Polar Surface Area:
131A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
365
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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