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88406-88-6

88406-88-6 | 1,4,2-Dithiazine, 3,5-diphenyl-

CAS No: 88406-88-6 Catalog No: AG004L7T MDL No:

Product Description

Catalog Number:
AG004L7T
Chemical Name:
1,4,2-Dithiazine, 3,5-diphenyl-
CAS Number:
88406-88-6
Molecular Formula:
C15H11NS2
Molecular Weight:
269.3845
IUPAC Name:
3,5-diphenyl-1,4,2-dithiazine
InChI:
InChI=1S/C15H11NS2/c1-3-7-12(8-4-1)14-11-17-16-15(18-14)13-9-5-2-6-10-13/h1-11H
InChI Key:
DUFYNBQNCWYFLT-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1=CSN=C(S1)c1ccccc1

Properties

Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.033g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.38g/mol
Monoisotopic Mass:
269.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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