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66052-10-6 | 1H-Imidazole, 2-(6-butoxy-2-naphthalenyl)-4,5-dihydro-
CAS No: 66052-10-6 Catalog No: AG00H8RK MDL No:
Product Description
Catalog Number:
AG00H8RK
Chemical Name:
1H-Imidazole, 2-(6-butoxy-2-naphthalenyl)-4,5-dihydro-
CAS Number:
66052-10-6
Molecular Formula:
C17H20N2O
Molecular Weight:
268.3535
IUPAC Name:
2-(6-butoxynaphthalen-2-yl)-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C17H20N2O/c1-2-3-10-20-16-7-6-13-11-15(5-4-14(13)12-16)17-18-8-9-19-17/h4-7,11-12H,2-3,8-10H2,1H3,(H,18,19)
InChI Key:
BSJRDGSJFVKQRD-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc2c(c1)ccc(c2)C1=NCCN1
Properties
Complexity:
342
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:
5
Topological Polar Surface Area:
33.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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