200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 117966-22-0
117966-22-0 | 1H-Indole, 2-acetyl-1-(phenylsulfonyl)-
CAS No: 117966-22-0 Catalog No: AG00774L MDL No:
Product Description
Catalog Number:
AG00774L
Chemical Name:
1H-Indole, 2-acetyl-1-(phenylsulfonyl)-
CAS Number:
117966-22-0
Molecular Formula:
C16H13NO3S
Molecular Weight:
299.3443
IUPAC Name:
1-[1-(benzenesulfonyl)indol-2-yl]ethanone
InChI:
InChI=1S/C16H13NO3S/c1-12(18)16-11-13-7-5-6-10-15(13)17(16)21(19,20)14-8-3-2-4-9-14/h2-11H,1H3
InChI Key:
XBQURWIIONNAKF-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2c(n1S(=O)(=O)c1ccccc1)cccc2
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.062g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.344g/mol
Monoisotopic Mass:
299.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.