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2-[N-(3-nitrophenyl)methanesulfonamido]acetamide

2-[N-(3-nitrophenyl)methanesulfonamido]acetamide

Formula: C9H11N3O5S

SMILES: CS(=O)(=O)N(CC(N)=O)C1=CC=CC(=C1)[N+]([O-])=O

IUPAC: 2-[N-(3-nitrophenyl)methanesulfonamido]acetamide

InChI: InChI=1S/C9H11N3O5S/c1-18(16,17)11(6-9(10)13)7-3-2-4-8(5-7)12(14)15/h2-5H,6H2,1H3,(H2,10,13)

Composition: C (39.56%), H (4.06%), N (15.38%), O (29.27%), S (11.73%)

Molar Mass: 273.26

Atom Count: 29

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 273.04194164
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey YAAGEEDXFUZLBD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.87
Topological Polar Surface Area 123.61
Polarizability 24.44
Ring Count 1
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C9H11N3O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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