Home Other Building Blocks 3-(methylsulfamoyl)propanoic acid

3-(methylsulfamoyl)propanoic acid

CAS No.:
933714-87-5
Catalog Number:
AG01A3QK
Molecular Formula:
C4H9NO4S
Molecular Weight:
167.1836
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Product Description
Catalog Number:
AG01A3QK
Chemical Name:
3-(methylsulfamoyl)propanoic acid
CAS Number:
933714-87-5
Molecular Formula:
C4H9NO4S
Molecular Weight:
167.1836
MDL Number:
MFCD11168961
IUPAC Name:
3-(methylsulfamoyl)propanoic acid
InChI:
InChI=1S/C4H9NO4S/c1-5-10(8,9)3-2-4(6)7/h5H,2-3H2,1H3,(H,6,7)
InChI Key:
MZDBJRROCIFXFX-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)CCC(=O)O
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.179g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2  
Properties