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88047-06-7 | Benzenesulfenamide, N-phenyl-N-(phenylthio)-
CAS No: 88047-06-7 Catalog No: AG004MH5 MDL No:
Product Description
Catalog Number:
AG004MH5
Chemical Name:
Benzenesulfenamide, N-phenyl-N-(phenylthio)-
CAS Number:
88047-06-7
Molecular Formula:
C18H15NS2
Molecular Weight:
309.4484
IUPAC Name:
N,N-bis(phenylsulfanyl)aniline
InChI:
InChI=1S/C18H15NS2/c1-4-10-16(11-5-1)19(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H
InChI Key:
NNEUYEPZCJGLEF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N(Sc1ccccc1)Sc1ccccc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.065g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.445g/mol
Monoisotopic Mass:
309.065g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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