Home Other Building Blocks 3-[methyl(prop-2-en-1-yl)sulfamoyl]benzoic acid

3-[methyl(prop-2-en-1-yl)sulfamoyl]benzoic acid

CAS No.:
1225764-58-8
Catalog Number:
AG01EM28
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EM28
Chemical Name:
3-[methyl(prop-2-en-1-yl)sulfamoyl]benzoic acid
CAS Number:
1225764-58-8
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
MDL Number:
MFCD16329726
IUPAC Name:
3-[methyl(prop-2-enyl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C11H13NO4S/c1-3-7-12(2)17(15,16)10-6-4-5-9(8-10)11(13)14/h3-6,8H,1,7H2,2H3,(H,13,14)
InChI Key:
RVPFXVZBGPTHSM-UHFFFAOYSA-N
SMILES:
C=CCN(S(=O)(=O)c1cccc(c1)C(=O)O)C
Properties
Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.288g/mol
Monoisotopic Mass:
255.057g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties