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88955-15-1 | 1,2,4-Oxadiazole, 5-[1-(6-methoxy-2-naphthalenyl)ethyl]-3-methyl-
CAS No: 88955-15-1 Catalog No: AG0046ZV MDL No:
Product Description
Catalog Number:
AG0046ZV
Chemical Name:
1,2,4-Oxadiazole, 5-[1-(6-methoxy-2-naphthalenyl)ethyl]-3-methyl-
CAS Number:
88955-15-1
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.3104
IUPAC Name:
5-[1-(6-methoxynaphthalen-2-yl)ethyl]-3-methyl-1,2,4-oxadiazole
InChI:
InChI=1S/C16H16N2O2/c1-10(16-17-11(2)18-20-16)12-4-5-14-9-15(19-3)7-6-13(14)8-12/h4-10H,1-3H3
InChI Key:
ZVHYDKBKZJVHPJ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccc(c2)C(c1onc(n1)C)C
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.316g/mol
Monoisotopic Mass:
268.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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