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125883-69-4 | 1H-Imidazole, 5-(2-naphthalenylmethyl)-
CAS No: 125883-69-4 Catalog No: AG000OXA MDL No:
Product Description
Catalog Number:
AG000OXA
Chemical Name:
1H-Imidazole, 5-(2-naphthalenylmethyl)-
CAS Number:
125883-69-4
Molecular Formula:
C14H12N2
Molecular Weight:
208.2585
IUPAC Name:
5-(naphthalen-2-ylmethyl)-1H-imidazole
InChI:
InChI=1S/C14H12N2/c1-2-4-13-7-11(5-6-12(13)3-1)8-14-9-15-10-16-14/h1-7,9-10H,8H2,(H,15,16)
InChI Key:
IVQBOAYNEIGUAQ-UHFFFAOYSA-N
SMILES:
c1ncc([nH]1)Cc1ccc2c(c1)cccc2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.264g/mol
Monoisotopic Mass:
208.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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