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111456-85-0 | 1H-Imidazole,1-(dimethoxyphenylmethyl)-
CAS No: 111456-85-0 Catalog No: AG007AKB MDL No:
Product Description
Catalog Number:
AG007AKB
Chemical Name:
1H-Imidazole,1-(dimethoxyphenylmethyl)-
CAS Number:
111456-85-0
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
IUPAC Name:
1-[dimethoxy(phenyl)methyl]imidazole
InChI:
InChI=1S/C12H14N2O2/c1-15-12(16-2,14-9-8-13-10-14)11-6-4-3-5-7-11/h3-10H,1-2H3
InChI Key:
KDFJJNPLCGDESX-UHFFFAOYSA-N
SMILES:
COC(n1cncc1)(c1ccccc1)OC
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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