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Home > Indoles and Oxindole > 342405-28-1
342405-28-1 | 1H-Indole-2-carbonylchloride, 1-(phenylsulfonyl)-
CAS No: 342405-28-1 Catalog No: AG007H1B MDL No:
Product Description
Catalog Number:
AG007H1B
Chemical Name:
1H-Indole-2-carbonylchloride, 1-(phenylsulfonyl)-
CAS Number:
342405-28-1
Molecular Formula:
C15H10ClNO3S
Molecular Weight:
319.7628
IUPAC Name:
1-(benzenesulfonyl)indole-2-carbonyl chloride
InChI:
InChI=1S/C15H10ClNO3S/c16-15(18)14-10-11-6-4-5-9-13(11)17(14)21(19,20)12-7-2-1-3-8-12/h1-10H
InChI Key:
MDDUSWMIZCDHNC-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc2c(n1S(=O)(=O)c1ccccc1)cccc2
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.007g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.759g/mol
Monoisotopic Mass:
319.007g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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