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1435804-37-7 | 2-(3-(Pyridin-3-yl)-1,2,4-oxadiazol-5-yl)ethan-1-amine dihydrochloride
CAS No: 1435804-37-7 Catalog No: AG01FLZE MDL No:MFCD23136085
Product Description
Catalog Number:
AG01FLZE
Chemical Name:
2-(3-(Pyridin-3-yl)-1,2,4-oxadiazol-5-yl)ethan-1-amine dihydrochloride
CAS Number:
1435804-37-7
Molecular Formula:
C9H12Cl2N4O
Molecular Weight:
263.1238
MDL Number:
MFCD23136085
IUPAC Name:
2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C9H10N4O.2ClH/c10-4-3-8-12-9(13-14-8)7-2-1-5-11-6-7;;/h1-2,5-6H,3-4,10H2;2*1H
InChI Key:
ZGOIGYILUTUTBN-UHFFFAOYSA-N
SMILES:
NCCc1onc(n1)c1cccnc1.Cl.Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.039g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
263.122g/mol
Monoisotopic Mass:
262.039g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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