Home Carboxys 2-methyl-5-(methylsulfamoyl)furan-3-carboxylic acid

2-methyl-5-(methylsulfamoyl)furan-3-carboxylic acid

CAS No.:
1376318-99-8
Catalog Number:
AG019YK3
Molecular Formula:
C7H9NO5S
Molecular Weight:
219.2151
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Product Description
Catalog Number:
AG019YK3
Chemical Name:
2-methyl-5-(methylsulfamoyl)furan-3-carboxylic acid
CAS Number:
1376318-99-8
Molecular Formula:
C7H9NO5S
Molecular Weight:
219.2151
MDL Number:
MFCD22196431
IUPAC Name:
2-methyl-5-(methylsulfamoyl)furan-3-carboxylic acid
InChI:
InChI=1S/C7H9NO5S/c1-4-5(7(9)10)3-6(13-4)14(11,12)8-2/h3,8H,1-2H3,(H,9,10)
InChI Key:
HOHGKXZYYMNXNC-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)c1oc(c(c1)C(=O)O)C
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.211g/mol
Monoisotopic Mass:
219.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties