2-ethyl-5-methyl-1H-imidazole-4-carboxylic acid

2-ethyl-5-methyl-1H-imidazole-4-carboxylic acid

CAS: 84255-25-4

Formula: C7H10N2O2

SMILES: CCC1=NC(C(O)=O)=C(C)N1

IUPAC: 2-ethyl-5-methyl-1H-imidazole-4-carboxylic acid

InChI: InChI=1S/C7H10N2O2/c1-3-5-8-4(2)6(9-5)7(10)11/h3H2,1-2H3,(H,8,9)(H,10,11)

Composition: C (54.54%), H (6.54%), N (18.17%), O (20.76%)

Molar Mass: 154.169

Atom Count: 21

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	154.07422757
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	DKRXGTYXXJTMFZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.11
Topological Polar Surface Area	65.98
Polarizability	14.91
Ring Count	1
Rotatable Bond Count	2

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90%	<2 Days	84255-25-4		$51.35-$86.31$51.35$63.37$86.31