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1260803-06-2 | 1H-Imidazole, 1-(4-bromo-2-methoxyphenyl)-4-ethyl-
CAS No: 1260803-06-2 Catalog No: AG000RB9 MDL No:MFCD15526796
Product Description
Catalog Number:
AG000RB9
Chemical Name:
1H-Imidazole, 1-(4-bromo-2-methoxyphenyl)-4-ethyl-
CAS Number:
1260803-06-2
Molecular Formula:
C12H13BrN2O
Molecular Weight:
281.1484
MDL Number:
MFCD15526796
IUPAC Name:
1-(4-bromo-2-methoxyphenyl)-4-ethylimidazole
InChI:
InChI=1S/C12H13BrN2O/c1-3-10-7-15(8-14-10)11-5-4-9(13)6-12(11)16-2/h4-8H,3H2,1-2H3
InChI Key:
GCIZGZRKBIZRHT-UHFFFAOYSA-N
SMILES:
COc1cc(Br)ccc1n1cnc(c1)CC
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.021g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.153g/mol
Monoisotopic Mass:
280.021g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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