2,6-dinitrobenzonitrile

2,6-dinitrobenzonitrile

CAS: 35213-00-4

Formula: C7H3N3O4

SMILES: [O-][N+](=O)C1=CC=CC(=C1C#N)[N+]([O-])=O

IUPAC: 2,6-dinitrobenzonitrile

InChI: InChI=1S/C7H3N3O4/c8-4-5-6(9(11)12)2-1-3-7(5)10(13)14/h1-3H

Composition: C (43.54%), H (1.57%), N (21.76%), O (33.14%)

Molar Mass: 193.118

Atom Count: 17

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.012355589
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	ZYDGHQSJZAFMLU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.42
Topological Polar Surface Area	110.07
Polarizability	16.11
Ring Count	1
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	35213-00-4		$12.42-$664.47$12.42$19.67$54.86$225.63$365.36$664.47

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	35213-00-4		$226.55-$629.05$226.55$629.05

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	35213-00-4		$420.00-$1,480.00$420.00$700.00$1,480.00