2-Thiophenecarboxylic acid, 5-acetyl-, methyl ester


Chemical Name: 2-Thiophenecarboxylic acid, 5-acetyl-, methyl ester
CAS Number: 4101-81-9
Product Number: AG00C6R9(AGN-PC-00L720)
Synonyms:
MDL No:
Molecular Formula: C8H8O3S
Molecular Weight: 184.21232

Identification/Properties


Properties
MP:
137-138℃
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
184.209g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
184.019g/mol
Monoisotopic Mass:
184.019g/mol
Topological Polar Surface Area:
71.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
203
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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