2-Thiophenecarboxylic acid, 3-(chlorosulfonyl)-, methyl ester


Chemical Name: 2-Thiophenecarboxylic acid, 3-(chlorosulfonyl)-, methyl ester
CAS Number: 59337-92-7
Product Number: AG003RRX(AGN-PC-0KK816)
Synonyms:
MDL No:
Molecular Formula: C6H5ClO4S2
Molecular Weight: 240.6845

Identification/Properties


Properties
MP:
61-64 °C(lit.)
BP:
364.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
240.672g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
239.932g/mol
Monoisotopic Mass:
239.932g/mol
Topological Polar Surface Area:
97.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
294
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


NMR Spectrum


Other Analytical Data


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