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102504-40-5 | 1,2,4-Oxadiazole-5-propanamine, N,N-diethyl-2,3-dihydro-3-phenyl-, hydrochloride (1:1)
CAS No: 102504-40-5 Catalog No: AG0007ME MDL No:
Product Description
Catalog Number:
AG0007ME
Chemical Name:
1,2,4-Oxadiazole-5-propanamine, N,N-diethyl-2,3-dihydro-3-phenyl-, hydrochloride (1:1)
CAS Number:
102504-40-5
Molecular Formula:
C15H24ClN3O
Molecular Weight:
297.8236
IUPAC Name:
diethyl-[3-(3-phenyl-2H-oxadiazol-5-yl)propyl]azanium;chloride
InChI:
InChI=1S/C15H23N3O.ClH/c1-3-17(4-2)12-8-11-15-13-18(16-19-15)14-9-6-5-7-10-14;/h5-7,9-10,13,16H,3-4,8,11-12H2,1-2H3;1H
InChI Key:
MYDGXUOXBHOOAM-UHFFFAOYSA-N
SMILES:
CCN(CCCC1=NC(NO1)c1ccccc1)CC.Cl
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.161g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.827g/mol
Monoisotopic Mass:
297.161g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
28.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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