ethyl 2-cyano-4-nitrobenzoate

ethyl 2-cyano-4-nitrobenzoate

Formula: C10H8N2O4

SMILES: CCOC(=O)C1=C(C=C(C=C1)[N+]([O-])=O)C#N

IUPAC: ethyl 2-cyano-4-nitrobenzoate

InChI: InChI=1S/C10H8N2O4/c1-2-16-10(13)9-4-3-8(12(14)15)5-7(9)6-11/h3-5H,2H2,1H3

Composition: C (54.55%), H (3.66%), N (12.72%), O (29.06%)

Molar Mass: 220.184

Atom Count: 24

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.048406746
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	XBSCOLXCSSDXHE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.87
Topological Polar Surface Area	93.23
Polarizability	20.39
Ring Count	1
Rotatable Bond Count	4

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C10H8N2O4		$1,760.00-$4,999.00$1,760.00$3,520.00$4,999.00