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Home > Bromides > 2118576-79-5
2118576-79-5 | Ethyl 3-Bromo-4-(1-imidazolyl)benzoate
CAS No: 2118576-79-5 Catalog No: AG01FLJM MDL No:
Product Description
Catalog Number:
AG01FLJM
Chemical Name:
Ethyl 3-Bromo-4-(1-imidazolyl)benzoate
CAS Number:
2118576-79-5
IUPAC Name:
ethyl 3-bromo-4-imidazol-1-ylbenzoate
InChI:
InChI=1S/C12H11BrN2O2/c1-2-17-12(16)9-3-4-11(10(13)7-9)15-6-5-14-8-15/h3-8H,2H2,1H3
InChI Key:
NLCRDDDGWJKLSW-UHFFFAOYSA-N
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.136g/mol
Monoisotopic Mass:
294g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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