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Home > Nitro Compounds > 10364-67-7
10364-67-7 | 3-(4-Nitrophenyl);-5-propyl-1,2,4-oxadiazole
CAS No: 10364-67-7 Catalog No: AG003I5C MDL No:MFCD09972144
Product Description
Catalog Number:
AG003I5C
Chemical Name:
3-(4-Nitrophenyl);-5-propyl-1,2,4-oxadiazole
CAS Number:
10364-67-7
Molecular Formula:
C11H11N3O3
Molecular Weight:
233.2233
MDL Number:
MFCD09972144
IUPAC Name:
3-(4-nitrophenyl)-5-propyl-1,2,4-oxadiazole
InChI:
InChI=1S/C11H11N3O3/c1-2-3-10-12-11(13-17-10)8-4-6-9(7-5-8)14(15)16/h4-7H,2-3H2,1H3
InChI Key:
ODAKJMUOVQDEPQ-UHFFFAOYSA-N
SMILES:
CCCc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.227g/mol
Monoisotopic Mass:
233.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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