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Home > Imidazoles > 67400-54-8
67400-54-8 | 1H-Imidazole,2-[(2,3-dimethylphenoxy)methyl]-4,5-dihydro-
CAS No: 67400-54-8 Catalog No: AG006HIF MDL No:
Product Description
Catalog Number:
AG006HIF
Chemical Name:
1H-Imidazole,2-[(2,3-dimethylphenoxy)methyl]-4,5-dihydro-
CAS Number:
67400-54-8
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
IUPAC Name:
2-[(2,3-dimethylphenoxy)methyl]-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C12H16N2O/c1-9-4-3-5-11(10(9)2)15-8-12-13-6-7-14-12/h3-5H,6-8H2,1-2H3,(H,13,14)
InChI Key:
WAAAGQHQBWTGTM-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1C)OCC1=NCCN1
EC Number:
266-680-8
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
33.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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