Benzoic acid, 5-(aminosulfonyl)-2-methoxy-, methyl ester


Chemical Name: Benzoic acid, 5-(aminosulfonyl)-2-methoxy-, methyl ester
CAS Number: 33045-52-2
Product Number: AG003ROG(AGN-PC-0JLLSZ)
Synonyms:
MDL No: MFCD01317542
Molecular Formula: C9H11NO5S
Molecular Weight: 245.2523

Identification/Properties


Properties
MP:
175-177 °C(lit.)
BP:
439.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
245.249g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
245.036g/mol
Monoisotopic Mass:
245.036g/mol
Topological Polar Surface Area:
104A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
347
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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