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16766-09-9 | Acetamide,N,N'-(dithiodi-4,1-phenylene)bis-
CAS No: 16766-09-9 Catalog No: AG007VSU MDL No:
Product Description
Catalog Number:
AG007VSU
Chemical Name:
Acetamide,N,N'-(dithiodi-4,1-phenylene)bis-
CAS Number:
16766-09-9
Molecular Formula:
C16H16N2O2S2
Molecular Weight:
332.4404
IUPAC Name:
N-[4-[(4-acetamidophenyl)disulfanyl]phenyl]acetamide
InChI:
InChI=1S/C16H16N2O2S2/c1-11(19)17-13-3-7-15(8-4-13)21-22-16-9-5-14(6-10-16)18-12(2)20/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChI Key:
XDZOVXPAGVIXBS-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)SSc1ccc(cc1)NC(=O)C
EC Number:
240-821-3
NSC Number:
82287
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.065g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
332.436g/mol
Monoisotopic Mass:
332.065g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| 4-Acetamido-N-(λ-triphenyl-phospho-ranyl-idene)benzene-sulfonamide. | Acta crystallographica. Section E, Structure reports online 20100501 |
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