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Home > Imidazoles > 88630-21-1
88630-21-1 | 1H-Imidazole, 1-[(2,3-diphenyloxiranyl)methyl]-
CAS No: 88630-21-1 Catalog No: AG004BQ9 MDL No:
Product Description
Catalog Number:
AG004BQ9
Chemical Name:
1H-Imidazole, 1-[(2,3-diphenyloxiranyl)methyl]-
CAS Number:
88630-21-1
Molecular Formula:
C18H16N2O
Molecular Weight:
276.3324
IUPAC Name:
1-[(2,3-diphenyloxiran-2-yl)methyl]imidazole
InChI:
InChI=1S/C18H16N2O/c1-3-7-15(8-4-1)17-18(21-17,13-20-12-11-19-14-20)16-9-5-2-6-10-16/h1-12,14,17H,13H2
InChI Key:
RJYKUQHHFVNUQM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1OC1(Cn1ccnc1)c1ccccc1
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.339g/mol
Monoisotopic Mass:
276.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
30.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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