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Home > Indoles and Oxindole > 95446-30-3
95446-30-3 | 2-(5-ethyl-1,3,4-oxadiazol-2-yl)-1H-indole
CAS No: 95446-30-3 Catalog No: AG018FWO MDL No:MFCD11986513
Product Description
Catalog Number:
AG018FWO
Chemical Name:
2-(5-ethyl-1,3,4-oxadiazol-2-yl)-1H-indole
CAS Number:
95446-30-3
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
MDL Number:
MFCD11986513
IUPAC Name:
2-ethyl-5-(1H-indol-2-yl)-1,3,4-oxadiazole
InChI:
InChI=1S/C12H11N3O/c1-2-11-14-15-12(16-11)10-7-8-5-3-4-6-9(8)13-10/h3-7,13H,2H2,1H3
InChI Key:
SQIKEZYXONLFHL-UHFFFAOYSA-N
SMILES:
CCc1nnc(o1)c1cc2c([nH]1)cccc2
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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