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4-chloro-5-nitro-2,1,3-benzoxadiazole

4-chloro-5-nitro-2,1,3-benzoxadiazole

Formula: C6H2ClN3O3

SMILES: [O-][N+](=O)C1=C(Cl)C2=NON=C2C=C1

IUPAC: 4-chloro-5-nitro-2,1,3-benzoxadiazole

InChI: InChI=1S/C6H2ClN3O3/c7-5-4(10(11)12)2-1-3-6(5)9-13-8-3/h1-2H

Composition: C (36.11%), H (1.01%), Cl (17.76%), N (21.06%), O (24.05%)

Molar Mass: 199.55

Atom Count: 15

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 198.9784686
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey UFKISXXUBSZJCC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.26
Topological Polar Surface Area 82.06
Polarizability 16.95
Ring Count 2
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C6H2ClN3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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