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1435804-68-4 | 2-(3-((4-Methoxyphenoxy)methyl)-1,2,4-oxadiazol-5-yl)ethan-1-amine hydrochloride
CAS No: 1435804-68-4 Catalog No: AG01FMI2 MDL No:MFCD23136071
Product Description
Catalog Number:
AG01FMI2
Chemical Name:
2-(3-((4-Methoxyphenoxy)methyl)-1,2,4-oxadiazol-5-yl)ethan-1-amine hydrochloride
CAS Number:
1435804-68-4
Molecular Formula:
C12H16ClN3O3
Molecular Weight:
285.7267
MDL Number:
MFCD23136071
IUPAC Name:
2-[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]ethanamine;hydrochloride
InChI:
InChI=1S/C12H15N3O3.ClH/c1-16-9-2-4-10(5-3-9)17-8-11-14-12(6-7-13)18-15-11;/h2-5H,6-8,13H2,1H3;1H
InChI Key:
DPSGRRORADPAFT-UHFFFAOYSA-N
SMILES:
NCCc1onc(n1)COc1ccc(cc1)OC.Cl
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.728g/mol
Monoisotopic Mass:
285.088g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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