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69978-05-8

69978-05-8 | 3-(2,4-Dinitrophenyl)-4-phenylsydnone

CAS No: 69978-05-8 Catalog No: AG00FPQ5 MDL No:

Product Description

Catalog Number:
AG00FPQ5
Chemical Name:
3-(2,4-Dinitrophenyl)-4-phenylsydnone
CAS Number:
69978-05-8
IUPAC Name:
3-(2,4-dinitrophenyl)-4-phenyloxadiazol-3-ium-5-olate
InChI:
InChI=1S/C14H8N4O6/c19-14-13(9-4-2-1-3-5-9)16(15-24-14)11-7-6-10(17(20)21)8-12(11)18(22)23/h1-8H
InChI Key:
HEYMLPYEHGROMD-UHFFFAOYSA-N

Properties

Complexity:
475  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.044g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.24g/mol
Monoisotopic Mass:
328.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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