Home Sulfos 4-(2-methoxyethanesulfonyl)benzoic acid

4-(2-methoxyethanesulfonyl)benzoic acid

CAS No.:
1016888-12-2
Catalog Number:
AG01A81V
Molecular Formula:
C10H12O5S
Molecular Weight:
244.2643
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A81V
Chemical Name:
4-(2-methoxyethanesulfonyl)benzoic acid
CAS Number:
1016888-12-2
Molecular Formula:
C10H12O5S
Molecular Weight:
244.2643
MDL Number:
MFCD09942739
IUPAC Name:
4-(2-methoxyethylsulfonyl)benzoic acid
InChI:
InChI=1S/C10H12O5S/c1-15-6-7-16(13,14)9-4-2-8(3-5-9)10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChI Key:
MPWHNNWSNQZCMD-UHFFFAOYSA-N
SMILES:
COCCS(=O)(=O)c1ccc(cc1)C(=O)O
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.041g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.261g/mol
Monoisotopic Mass:
244.041g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
89A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties