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2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3,5-dinitrobenzamide

2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3,5-dinitrobenzamide

Formula: C12H10N4O6

SMILES: CC1=CC(NC(=O)C2=CC(=CC(=C2C)[N+]([O-])=O)[N+]([O-])=O)=NO1

IUPAC: 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3,5-dinitrobenzamide

InChI: InChI=1S/C12H10N4O6/c1-6-3-11(14-22-6)13-12(17)9-4-8(15(18)19)5-10(7(9)2)16(20)21/h3-5H,1-2H3,(H,13,14,17)

Composition: C (47.07%), H (3.29%), N (18.30%), O (31.35%)

Molar Mass: 306.234

Atom Count: 32

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 306.060034058
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey DWKSZDQPZHQKJO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.18
Topological Polar Surface Area 141.41
Polarizability 26.48
Ring Count 2
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H10N4O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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