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88642-53-9 | 2H-1,3-Thiazin-2-imine, 4,6-diphenyl-, monoperchlorate
CAS No: 88642-53-9 Catalog No: AG004A9I MDL No:
Product Description
Catalog Number:
AG004A9I
Chemical Name:
2H-1,3-Thiazin-2-imine, 4,6-diphenyl-, monoperchlorate
CAS Number:
88642-53-9
Molecular Formula:
C16H13ClN2O4S
Molecular Weight:
364.8034
IUPAC Name:
4,6-diphenyl-1,3-thiazin-2-imine;perchloric acid
InChI:
InChI=1S/C16H12N2S.ClHO4/c17-16-18-14(12-7-3-1-4-8-12)11-15(19-16)13-9-5-2-6-10-13;2-1(3,4)5/h1-11,17H;(H,2,3,4,5)
InChI Key:
HVPJGHIJEAEZMN-UHFFFAOYSA-N
SMILES:
O[Cl](=O)(=O)=O.N=c1nc(cc(s1)c1ccccc1)c1ccccc1
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.028g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
364.8g/mol
Monoisotopic Mass:
364.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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