Home Carboxys 2-methyl-5-sulfamoylfuran-3-carboxylic acid

2-methyl-5-sulfamoylfuran-3-carboxylic acid

CAS No.:
408536-00-5
Catalog Number:
AG019YZ7
Molecular Formula:
C6H7NO5S
Molecular Weight:
205.1885
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Product Description
Catalog Number:
AG019YZ7
Chemical Name:
2-methyl-5-sulfamoylfuran-3-carboxylic acid
CAS Number:
408536-00-5
Molecular Formula:
C6H7NO5S
Molecular Weight:
205.1885
MDL Number:
MFCD19302200
IUPAC Name:
2-methyl-5-sulfamoylfuran-3-carboxylic acid
InChI:
InChI=1S/C6H7NO5S/c1-3-4(6(8)9)2-5(12-3)13(7,10)11/h2H,1H3,(H,8,9)(H2,7,10,11)
InChI Key:
CELQRFDDSWCLGN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(oc1C)S(=O)(=O)N
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.184g/mol
Monoisotopic Mass:
205.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties