ethyl 2-(3-iodophenyl)-5-methyl-1H-imidazole-4-carboxylate

ethyl 2-(3-iodophenyl)-5-methyl-1H-imidazole-4-carboxylate

Formula: C13H13IN2O2

SMILES: CCOC(=O)C1=C(C)NC(=N1)C1=CC(I)=CC=C1

IUPAC: ethyl 2-(3-iodophenyl)-5-methyl-1H-imidazole-4-carboxylate

InChI: InChI=1S/C13H13IN2O2/c1-3-18-13(17)11-8(2)15-12(16-11)9-5-4-6-10(14)7-9/h4-7H,3H2,1-2H3,(H,15,16)

Composition: C (43.84%), H (3.68%), I (35.63%), N (7.87%), O (8.98%)

Molar Mass: 356.163

Atom Count: 31

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	356.00217
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	AVHBSMGVKCXWPT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.03
Topological Polar Surface Area	54.98
Polarizability	30.55
Ring Count	2
Rotatable Bond Count	4

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C13H13IN2O2		$628.00-$2,860.00$628.00$1,540.00$2,860.00