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Home > Nitro Compounds > 6136-89-6
6136-89-6 | 3-(3-nitrophenyl)-5-phenethyl-1,2,4-oxadiazole
CAS No: 6136-89-6 Catalog No: AG00F3B7 MDL No:
Product Description
Catalog Number:
AG00F3B7
Chemical Name:
3-(3-nitrophenyl)-5-phenethyl-1,2,4-oxadiazole
CAS Number:
6136-89-6
IUPAC Name:
3-(3-nitrophenyl)-5-(2-phenylethyl)-1,2,4-oxadiazole
InChI:
InChI=1S/C16H13N3O3/c20-19(21)14-8-4-7-13(11-14)16-17-15(22-18-16)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2
InChI Key:
YVPDFWGUWBVCBF-UHFFFAOYSA-N
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.096g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.298g/mol
Monoisotopic Mass:
295.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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