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96360-12-2 | Acetamide, N-acetyl-N-1,2-benzisothiazol-3-yl-
CAS No: 96360-12-2 Catalog No: AG0067RO MDL No:
Product Description
Catalog Number:
AG0067RO
Chemical Name:
Acetamide, N-acetyl-N-1,2-benzisothiazol-3-yl-
CAS Number:
96360-12-2
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
IUPAC Name:
N-acetyl-N-(1,2-benzothiazol-3-yl)acetamide
InChI:
InChI=1S/C11H10N2O2S/c1-7(14)13(8(2)15)11-9-5-3-4-6-10(9)16-12-11/h3-6H,1-2H3
InChI Key:
ILACCGRSUGTCEF-UHFFFAOYSA-N
SMILES:
CC(=O)N(c1nsc2c1cccc2)C(=O)C
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.273g/mol
Monoisotopic Mass:
234.046g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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