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Home > Imidazoles > 89781-64-6
89781-64-6 | 2-Naphthalenol, 3-(1,1-dimethylethyl)-7,8-dihydro-6-(1H-imidazol-1-yl)-
CAS No: 89781-64-6 Catalog No: AG003ZZW MDL No:
Product Description
Catalog Number:
AG003ZZW
Chemical Name:
2-Naphthalenol, 3-(1,1-dimethylethyl)-7,8-dihydro-6-(1H-imidazol-1-yl)-
CAS Number:
89781-64-6
Molecular Formula:
C17H20N2O
Molecular Weight:
268.3535
IUPAC Name:
3-tert-butyl-6-imidazol-1-yl-7,8-dihydronaphthalen-2-ol
InChI:
InChI=1S/C17H20N2O/c1-17(2,3)15-9-13-8-14(19-7-6-18-11-19)5-4-12(13)10-16(15)20/h6-11,20H,4-5H2,1-3H3
InChI Key:
CEOXHWRGSADPJO-UHFFFAOYSA-N
SMILES:
Oc1cc2CCC(=Cc2cc1C(C)(C)C)n1cncc1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.158g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.36g/mol
Monoisotopic Mass:
268.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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