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ethyl 4-[(1E)-2-(1H-imidazol-2-yl)diazen-1-yl]benzoate

ethyl 4-[(1E)-2-(1H-imidazol-2-yl)diazen-1-yl]benzoate

Formula: C12H12N4O2

SMILES: CCOC(=O)C1=CC=C(C=C1)N=NC1=NC=CN1

IUPAC: ethyl 4-[(1E)-2-(1H-imidazol-2-yl)diazen-1-yl]benzoate

InChI: InChI=1S/C12H12N4O2/c1-2-18-11(17)9-3-5-10(6-4-9)15-16-12-13-7-8-14-12/h3-8H,2H2,1H3,(H,13,14)/b16-15+

Composition: C (59.01%), H (4.95%), N (22.94%), O (13.10%)

Molar Mass: 244.254

Atom Count: 30

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 244.096025642
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QVTWOUSPRQFLHE-FOCLMDBBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 69.58
Topological Polar Surface Area 79.7
Polarizability 24.68
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H12N4O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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