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80199-93-5 | 1H-Imidazole, 1-[2-[4-(phenylmethoxy)phenyl]ethyl]-
CAS No: 80199-93-5 Catalog No: AG0054DI MDL No:
Product Description
Catalog Number:
AG0054DI
Chemical Name:
1H-Imidazole, 1-[2-[4-(phenylmethoxy)phenyl]ethyl]-
CAS Number:
80199-93-5
Molecular Formula:
C18H18N2O
Molecular Weight:
278.3483
IUPAC Name:
1-[2-(4-phenylmethoxyphenyl)ethyl]imidazole
InChI:
InChI=1S/C18H18N2O/c1-2-4-17(5-3-1)14-21-18-8-6-16(7-9-18)10-12-20-13-11-19-15-20/h1-9,11,13,15H,10,12,14H2
InChI Key:
ZGPCRMIIWBZNGF-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COc1ccc(cc1)CCn1cncc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.142g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.355g/mol
Monoisotopic Mass:
278.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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