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N1-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitrobenzene-1,3-diamine

N1-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitrobenzene-1,3-diamine

Formula: C12H15N5O4

SMILES: CC1=NON=C1OCCCNC1=CC=C(C(N)=C1)[N+]([O-])=O

IUPAC: N1-{3-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propyl}-4-nitrobenzene-1,3-diamine

InChI: InChI=1S/C12H15N5O4/c1-8-12(16-21-15-8)20-6-2-5-14-9-3-4-11(17(18)19)10(13)7-9/h3-4,7,14H,2,5-6,13H2,1H3

Composition: C (49.14%), H (5.16%), N (23.88%), O (21.82%)

Molar Mass: 293.283

Atom Count: 36

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 293.112403983
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey JRTLZQPGUUQTSW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.97
Topological Polar Surface Area 129.34
Polarizability 27.31
Ring Count 2
Rotatable Bond Count 7

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H15N5O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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