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2-(2-nitrophenoxy)acetylurea

2-(2-nitrophenoxy)acetylurea

Formula: C9H9N3O5

SMILES: NC(=O)NC(=O)COC1=CC=CC=C1[N+]([O-])=O

IUPAC: [2-(2-nitrophenoxy)acetyl]urea

InChI: InChI=1S/C9H9N3O5/c10-9(14)11-8(13)5-17-7-4-2-1-3-6(7)12(15)16/h1-4H,5H2,(H3,10,11,13,14)

Composition: C (45.19%), H (3.79%), N (17.57%), O (33.44%)

Molar Mass: 239.187

Atom Count: 26

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 239.054220402
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey BRKAXFYHVMJVRL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.99
Topological Polar Surface Area 124.56
Polarizability 21.03
Ring Count 1
Rotatable Bond Count 4

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C9H9N3O5 Quote Only