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N-{[(2-nitrophenyl)methyl]imino}guanidine

N-{[(2-nitrophenyl)methyl]imino}guanidine

CAS: 102632-31-5

Formula: C8H9N5O2

SMILES: NC(=N)N=NCC1=CC=CC=C1[N+]([O-])=O

IUPAC: N-{[(2-nitrophenyl)methyl]imino}guanidine

InChI: InChI=1S/C8H9N5O2/c9-8(10)12-11-5-6-3-1-2-4-7(6)13(14)15/h1-4H,5H2,(H3,9,10)

Composition: C (46.38%), H (4.38%), N (33.80%), O (15.44%)

Molar Mass: 207.193

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 207.07562455
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey JAXCLEDZELCKLR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.67
Topological Polar Surface Area 117.73
Polarizability 19.51
Ring Count 1
Rotatable Bond Count 3

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OTAVA LTD.
Purity LeadTime CAS PacketSize UnitPrice
95% <10 Days 102632-31-5 $162.27-$356.79$162.27$251.22$356.79
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
% <6 Days 102632-31-5 $416.30$416.30
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