2-Thiophenecarboxylic acid, 1,1-dimethylethyl ester


Chemical Name: 2-Thiophenecarboxylic acid, 1,1-dimethylethyl ester
CAS Number: 939-62-8
Product Number: AG00H6Y7(AGN-PC-00MSSB)
Synonyms:
MDL No:
Molecular Formula: C9H12O2S
Molecular Weight: 184.2554

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
184.253g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
184.056g/mol
Monoisotopic Mass:
184.056g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
172
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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