Home Other Building Blocks 4-[(Dimethylsulfamoyl)methyl]benzoic acid

4-[(Dimethylsulfamoyl)methyl]benzoic acid

CAS No.:
1098366-68-7
Catalog Number:
AG01EHC1
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$313
- +
5g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG01EHC1
Chemical Name:
4-[(Dimethylsulfamoyl)methyl]benzoic acid
CAS Number:
1098366-68-7
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
MDL Number:
MFCD11647510
IUPAC Name:
4-(dimethylsulfamoylmethyl)benzoic acid
InChI:
InChI=1S/C10H13NO4S/c1-11(2)16(14,15)7-8-3-5-9(6-4-8)10(12)13/h3-6H,7H2,1-2H3,(H,12,13)
InChI Key:
NKPRFCUTOQJLGC-UHFFFAOYSA-N
SMILES:
CN(S(=O)(=O)Cc1ccc(cc1)C(=O)O)C
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.277g/mol
Monoisotopic Mass:
243.057g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties