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5-(2-nitrophenyl)-2H-1,2,3,4-tetrazole

5-(2-nitrophenyl)-2H-1,2,3,4-tetrazole

CAS: 53257-40-2

Formula: C7H5N5O2

SMILES: [O-][N+](=O)C1=CC=CC=C1C1=NNN=N1

IUPAC: 5-(2-nitrophenyl)-2H-1,2,3,4-tetrazole

InChI: InChI=1S/C7H5N5O2/c13-12(14)6-4-2-1-3-5(6)7-8-10-11-9-7/h1-4H,(H,8,9,10,11)

Composition: C (43.98%), H (2.64%), N (36.64%), O (16.74%)

Molar Mass: 191.15

Atom Count: 19

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 191.044324421
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey HENCYJMPEDACFZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.74
Topological Polar Surface Area 97.6
Polarizability 17.62
Ring Count 2
Rotatable Bond Count 2

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