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838906-38-0 | Benzenesulfonamide, 4-methyl-N-(tetrahydro-2,6-dioxo-2H-pyran-4-yl)-
CAS No: 838906-38-0 Catalog No: AG004RG2 MDL No:
Product Description
Catalog Number:
AG004RG2
Chemical Name:
Benzenesulfonamide, 4-methyl-N-(tetrahydro-2,6-dioxo-2H-pyran-4-yl)-
CAS Number:
838906-38-0
Molecular Formula:
C12H13NO5S
Molecular Weight:
283.3003
IUPAC Name:
N-(2,6-dioxooxan-4-yl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C12H13NO5S/c1-8-2-4-10(5-3-8)19(16,17)13-9-6-11(14)18-12(15)7-9/h2-5,9,13H,6-7H2,1H3
InChI Key:
ZCUPLPGLIXDPIR-UHFFFAOYSA-N
SMILES:
O=C1CC(CC(=O)O1)NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.298g/mol
Monoisotopic Mass:
283.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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