methyl (2Z)-2-cyano-3-(5-nitrofuran-2-yl)prop-2-enoate

methyl (2Z)-2-cyano-3-(5-nitrofuran-2-yl)prop-2-enoate

Formula: C9H6N2O5

SMILES: COC(=O)C(=C/C1=CC=C(O1)[N+]([O-])=O)C#N

IUPAC: methyl (2Z)-2-cyano-3-(5-nitrofuran-2-yl)prop-2-enoate

InChI: InChI=1S/C9H6N2O5/c1-15-9(12)6(5-10)4-7-2-3-8(16-7)11(13)14/h2-4H,1H3/b6-4-

Composition: C (48.66%), H (2.72%), N (12.61%), O (36.01%)

Molar Mass: 222.156

Atom Count: 22

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	222.027671301
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	VTPSQKRYJMAJDL-XQRVVYSFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.85
Topological Polar Surface Area	106.37
Polarizability	18.89
Ring Count	1
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C9H6N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00