Home Sulfos 1-[(4-chlorophenyl)sulfonyl]cyclopropanecarboxylic acid

1-[(4-chlorophenyl)sulfonyl]cyclopropanecarboxylic acid

CAS No.:
505071-92-1
Catalog Number:
AG00I92I
Molecular Formula:
C10H9ClO4S
Molecular Weight:
260.6941
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Product Description
Catalog Number:
AG00I92I
Chemical Name:
1-[(4-chlorophenyl)sulfonyl]cyclopropanecarboxylic acid
CAS Number:
505071-92-1
Molecular Formula:
C10H9ClO4S
Molecular Weight:
260.6941
MDL Number:
MFCD00764657
IUPAC Name:
1-(4-chlorophenyl)sulfonylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H9ClO4S/c11-7-1-3-8(4-2-7)16(14,15)10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)
InChI Key:
GAABDRSLTXUNQW-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)S(=O)(=O)c1ccc(cc1)Cl
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.991g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.688g/mol
Monoisotopic Mass:
259.991g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties