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ethyl 5-methyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole-4-carboxylate

ethyl 5-methyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole-4-carboxylate

Formula: C14H13F3N2O2

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

IUPAC: ethyl 5-methyl-2-[3-(trifluoromethyl)phenyl]-1H-imidazole-4-carboxylate

InChI: InChI=1S/C14H13F3N2O2/c1-3-21-13(20)11-8(2)18-12(19-11)9-5-4-6-10(7-9)14(15,16)17/h4-7H,3H2,1-2H3,(H,18,19)

Composition: C (56.38%), H (4.39%), F (19.11%), N (9.39%), O (10.73%)

Molar Mass: 298.265

Atom Count: 34

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 298.092912156
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CKCHTECIZCGJNT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.64
Topological Polar Surface Area 54.98
Polarizability 26.56
Ring Count 2
Rotatable Bond Count 5

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C14H13F3N2O2 $1,540.00-$2,860.00$1,540.00$1,760.00$2,860.00
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