Home Sulfos 1H-Indole-3-sulfonyl chloride, 1-[(4-methylphenyl)sulfonyl]-

1H-Indole-3-sulfonyl chloride, 1-[(4-methylphenyl)sulfonyl]-

CAS No.:
881406-30-0
Catalog Number:
AG00IEZK
Molecular Formula:
C15H12ClNO4S2
Molecular Weight:
369.8431
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Product Description
Catalog Number:
AG00IEZK
Chemical Name:
1H-Indole-3-sulfonyl chloride, 1-[(4-methylphenyl)sulfonyl]-
CAS Number:
881406-30-0
Molecular Formula:
C15H12ClNO4S2
Molecular Weight:
369.8431
MDL Number:
MFCD21362384
IUPAC Name:
1-(4-methylphenyl)sulfonylindole-3-sulfonyl chloride
InChI:
InChI=1S/C15H12ClNO4S2/c1-11-6-8-12(9-7-11)23(20,21)17-10-15(22(16,18)19)13-4-2-3-5-14(13)17/h2-10H,1H3
InChI Key:
IJGVMXRUDJCUFD-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1cc(c2c1cccc2)S(=O)(=O)Cl
Properties
Complexity:
629  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.99g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.834g/mol
Monoisotopic Mass:
368.99g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
90A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties