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93372-28-2

93372-28-2 | Diazene, (4-methoxybenzoyl)[1-[(2-nitrophenyl)hydrazono]ethyl]-

CAS No: 93372-28-2 Catalog No: AG006G7K MDL No:

Product Description

Catalog Number:
AG006G7K
Chemical Name:
Diazene, (4-methoxybenzoyl)[1-[(2-nitrophenyl)hydrazono]ethyl]-
CAS Number:
93372-28-2
Molecular Formula:
C16H15N5O4
Molecular Weight:
341.3214
IUPAC Name:
4-methoxy-N-[1-[(2-nitrophenyl)diazenyl]ethylideneamino]benzamide
InChI:
InChI=1S/C16H15N5O4/c1-11(17-19-14-5-3-4-6-15(14)21(23)24)18-20-16(22)12-7-9-13(25-2)10-8-12/h3-10H,1-2H3,(H,20,22)
InChI Key:
MKWAMJMTKXLBPF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)N=NC(=NNc1ccccc1[N+](=O)[O-])C

Properties

Complexity:
523  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.112g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
341.327g/mol
Monoisotopic Mass:
341.112g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

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