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


Chemical Name: 3-Thiophenecarboxylic acid, 2-methyl-, methyl ester
CAS Number: 53562-51-9
Product Number: AG00D8YN(AGN-PC-00L2GU)
Synonyms:
MDL No:
Molecular Formula: C7H8O2S
Molecular Weight: 156.2022

Identification/Properties


Properties
BP:
202.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
156.199g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
156.025g/mol
Monoisotopic Mass:
156.025g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
136
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:
H302
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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