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1258650-02-0 | N-(3-acetylphenyl)-N-methanesulfonylmethanesulfonamide
CAS No: 1258650-02-0 Catalog No: AG01AB3D MDL No:MFCD17977051
Product Description
Catalog Number:
AG01AB3D
Chemical Name:
N-(3-acetylphenyl)-N-methanesulfonylmethanesulfonamide
CAS Number:
1258650-02-0
Molecular Formula:
C10H13NO5S2
Molecular Weight:
291.3439
MDL Number:
MFCD17977051
IUPAC Name:
N-(3-acetylphenyl)-N-methylsulfonylmethanesulfonamide
InChI:
InChI=1S/C10H13NO5S2/c1-8(12)9-5-4-6-10(7-9)11(17(2,13)14)18(3,15)16/h4-7H,1-3H3
InChI Key:
OXYRAWQEFLAYQF-UHFFFAOYSA-N
SMILES:
CC(=O)c1cccc(c1)N(S(=O)(=O)C)S(=O)(=O)C
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.024g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.336g/mol
Monoisotopic Mass:
291.024g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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