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4-nitro-N-(oxolan-2-ylmethyl)benzamide

4-nitro-N-(oxolan-2-ylmethyl)benzamide

Formula: C12H14N2O4

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)NCC1CCCO1

IUPAC: 4-nitro-N-[(oxolan-2-yl)methyl]benzamide

InChI: InChI=1/C12H14N2O4/c15-12(13-8-11-2-1-7-18-11)9-3-5-10(6-4-9)14(16)17/h3-6,11H,1-2,7-8H2,(H,13,15)

Composition: C (57.59%), H (5.64%), N (11.19%), O (25.57%)

Molar Mass: 250.254

Atom Count: 32

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 250.095356939
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ZIDAIXFZQZFHDE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.61
Topological Polar Surface Area 81.47
Polarizability 24.27
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H14N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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