5-methyl-2-(4-nitrophenyl)-1H-imidazole-4-carboxylic acid

5-methyl-2-(4-nitrophenyl)-1H-imidazole-4-carboxylic acid

Formula: C11H9N3O4

SMILES: CC1=C(N=C(N1)C1=CC=C(C=C1)[N+]([O-])=O)C(O)=O

IUPAC: 5-methyl-2-(4-nitrophenyl)-1H-imidazole-4-carboxylic acid

InChI: InChI=1S/C11H9N3O4/c1-6-9(11(15)16)13-10(12-6)7-2-4-8(5-3-7)14(17)18/h2-5H,1H3,(H,12,13)(H,15,16)

Composition: C (53.44%), H (3.67%), N (17.00%), O (25.89%)

Molar Mass: 247.21

Atom Count: 27

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	247.059305782
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	WAQHWYDNCUPACU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.47
Topological Polar Surface Area	109.12
Polarizability	23.45
Ring Count	2
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C11H9N3O4		$1,540.00-$2,860.00$1,540.00$1,760.00$2,860.00