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5-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-4-carboxylic acid

5-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-4-carboxylic acid

Formula: C10H16N2O3

SMILES: CCCC1=NC(C(O)=O)=C(N1)C(C)(C)O

IUPAC: 5-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-4-carboxylic acid

InChI: InChI=1S/C10H16N2O3/c1-4-5-6-11-7(9(13)14)8(12-6)10(2,3)15/h15H,4-5H2,1-3H3,(H,11,12)(H,13,14)

Composition: C (56.59%), H (7.60%), N (13.20%), O (22.61%)

Molar Mass: 212.249

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 212.116092383
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey FREDNUVVPQMYKQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.32
Topological Polar Surface Area 86.21
Polarizability 21.13
Ring Count 1
Rotatable Bond Count 4

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C10H16N2O3 Quote Only