Home Sulfos 1-methyl-5-(trichloroacetyl)-1H-pyrrole-3-sulfonyl chloride

1-methyl-5-(trichloroacetyl)-1H-pyrrole-3-sulfonyl chloride

CAS No.:
875163-47-6
Catalog Number:
AG00IENH
Molecular Formula:
C7H5Cl4NO3S
Molecular Weight:
324.9965
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Product Description
Catalog Number:
AG00IENH
Chemical Name:
1-methyl-5-(trichloroacetyl)-1H-pyrrole-3-sulfonyl chloride
CAS Number:
875163-47-6
Molecular Formula:
C7H5Cl4NO3S
Molecular Weight:
324.9965
MDL Number:
MFCD07838414
IUPAC Name:
1-methyl-5-(2,2,2-trichloroacetyl)pyrrole-3-sulfonyl chloride
InChI:
InChI=1S/C7H5Cl4NO3S/c1-12-3-4(16(11,14)15)2-5(12)6(13)7(8,9)10/h2-3H,1H3
InChI Key:
RHFRYNZCFXKAIO-UHFFFAOYSA-N
SMILES:
Cn1cc(cc1C(=O)C(Cl)(Cl)Cl)S(=O)(=O)Cl
Properties
Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.871g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
324.981g/mol
Monoisotopic Mass:
322.874g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties