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5-chloro-2-hydroxy-N-methyl-3-nitrobenzamide

5-chloro-2-hydroxy-N-methyl-3-nitrobenzamide

Formula: C8H7ClN2O4

SMILES: CNC(=O)C1=CC(Cl)=CC(=C1O)[N+]([O-])=O

IUPAC: 5-chloro-2-hydroxy-N-methyl-3-nitrobenzamide

InChI: InChI=1S/C8H7ClN2O4/c1-10-8(13)5-2-4(9)3-6(7(5)12)11(14)15/h2-3,12H,1H3,(H,10,13)

Composition: C (41.67%), H (3.06%), Cl (15.37%), N (12.15%), O (27.75%)

Molar Mass: 230.6

Atom Count: 22

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 230.0094344
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey DFAJJIGUSYIDFZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.14
Topological Polar Surface Area 92.47
Polarizability 19.59
Ring Count 1
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C8H7ClN2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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