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652976-66-4 | Benzenesulfonamide, 4-methyl-N-[(3R)-tetrahydro-2,5-dioxo-3-furanyl]-
CAS No: 652976-66-4 Catalog No: AG006TMF MDL No:
Product Description
Catalog Number:
AG006TMF
Chemical Name:
Benzenesulfonamide, 4-methyl-N-[(3R)-tetrahydro-2,5-dioxo-3-furanyl]-
CAS Number:
652976-66-4
Molecular Formula:
C11H11NO5S
Molecular Weight:
269.2737
IUPAC Name:
N-[(3R)-2,5-dioxooxolan-3-yl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C11H11NO5S/c1-7-2-4-8(5-3-7)18(15,16)12-9-6-10(13)17-11(9)14/h2-5,9,12H,6H2,1H3/t9-/m1/s1
InChI Key:
VNMAMGMXPZCSRG-SECBINFHSA-N
SMILES:
O=C1OC(=O)C[C@H]1NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
269.036g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.271g/mol
Monoisotopic Mass:
269.036g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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