Home Aminos 2-[methyl(prop-2-en-1-yl)amino]-5-sulfamoylbenzoic acid

2-[methyl(prop-2-en-1-yl)amino]-5-sulfamoylbenzoic acid

CAS No.:
1553629-71-2
Catalog Number:
AG01EM2E
Molecular Formula:
C11H14N2O4S
Molecular Weight:
270.3049
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Product Description
Catalog Number:
AG01EM2E
Chemical Name:
2-[methyl(prop-2-en-1-yl)amino]-5-sulfamoylbenzoic acid
CAS Number:
1553629-71-2
Molecular Formula:
C11H14N2O4S
Molecular Weight:
270.3049
MDL Number:
MFCD25729629
IUPAC Name:
2-[methyl(prop-2-enyl)amino]-5-sulfamoylbenzoic acid
InChI:
InChI=1S/C11H14N2O4S/c1-3-6-13(2)10-5-4-8(18(12,16)17)7-9(10)11(14)15/h3-5,7H,1,6H2,2H3,(H,14,15)(H2,12,16,17)
InChI Key:
WPZBEHVDBWLTFN-UHFFFAOYSA-N
SMILES:
C=CCN(c1ccc(cc1C(=O)O)S(=O)(=O)N)C
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.067g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.303g/mol
Monoisotopic Mass:
270.067g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties