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Home > Bromides > 1001755-61-8
1001755-61-8 | 1H-Imidazole, 4,5-dibromo-1-(ethoxymethyl)-2-(2-ethoxy-1-naphthalenyl)-
CAS No: 1001755-61-8 Catalog No: AG000158 MDL No:
Product Description
Catalog Number:
AG000158
Chemical Name:
1H-Imidazole, 4,5-dibromo-1-(ethoxymethyl)-2-(2-ethoxy-1-naphthalenyl)-
CAS Number:
1001755-61-8
Molecular Formula:
C18H18Br2N2O2
Molecular Weight:
454.1557
IUPAC Name:
4,5-dibromo-1-(ethoxymethyl)-2-(2-ethoxynaphthalen-1-yl)imidazole
InChI:
InChI=1S/C18H18Br2N2O2/c1-3-23-11-22-17(20)16(19)21-18(22)15-13-8-6-5-7-12(13)9-10-14(15)24-4-2/h5-10H,3-4,11H2,1-2H3
InChI Key:
FHLFLIHWQFOGMT-UHFFFAOYSA-N
SMILES:
CCOCn1c(Br)c(nc1c1c(OCC)ccc2c1cccc2)Br
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
453.971g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
454.162g/mol
Monoisotopic Mass:
451.974g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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