nifursol

nifursol

CAS: 16915-70-1

Formula: C12H7N5O9

SMILES: OC1=C(C=C(C=C1C(=O)NN=CC1=CC=C(O1)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O

IUPAC: 2-hydroxy-3,5-dinitro-N'-[(E)-(5-nitrofuran-2-yl)methylidene]benzohydrazide

InChI: InChI=1S/C12H7N5O9/c18-11-8(3-6(15(20)21)4-9(11)16(22)23)12(19)14-13-5-7-1-2-10(26-7)17(24)25/h1-5,18H,(H,14,19)/b13-5+

Composition: C (39.47%), H (1.93%), N (19.18%), O (39.43%)

Molar Mass: 365.214

Atom Count: 33

Heavy Atom Count: 26

Properties

Properties

Common Names	nifursol
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	365.024376825
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	2
InChIKey	XXUXXCZCUGIGPP-WLRTZDKTSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.82
Topological Polar Surface Area	204.25
Polarizability	29.03
Ring Count	2
Rotatable Bond Count	6

Suppliers

Key Organics Ltd

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	16915-70-1		$51.35-$712.31$51.35$63.37$86.31$442.46$712.31

AA BLOCKS INC

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	16915-70-1		$69.00-$402.50$69.00$134.55$236.90$402.50

Molnova Chemicals

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98%	<4 Days	16915-70-1		$38.22$38.22

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<16 Days	16915-70-1		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00