Home Sulfos 3-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid

3-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid

CAS No.:
944895-22-1
Catalog Number:
AG00J274
Molecular Formula:
C9H11NO4S2
Molecular Weight:
261.3179
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$444
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Product Description
Catalog Number:
AG00J274
Chemical Name:
3-(Pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylic acid
CAS Number:
944895-22-1
Molecular Formula:
C9H11NO4S2
Molecular Weight:
261.3179
MDL Number:
MFCD09455188
IUPAC Name:
3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylic acid
InChI:
InChI=1S/C9H11NO4S2/c11-9(12)8-7(3-6-15-8)16(13,14)10-4-1-2-5-10/h3,6H,1-2,4-5H2,(H,11,12)
InChI Key:
ZEMWQHYHFKHRHF-UHFFFAOYSA-N
SMILES:
OC(=O)c1sccc1S(=O)(=O)N1CCCC1
Properties
Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.013g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.31g/mol
Monoisotopic Mass:
261.013g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties