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1374407-72-3 | 3-(3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl)propan-1-amine hydrochloride
CAS No: 1374407-72-3 Catalog No: AG01FLSY MDL No:MFCD22201585
Product Description
Catalog Number:
AG01FLSY
Chemical Name:
3-(3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl)propan-1-amine hydrochloride
CAS Number:
1374407-72-3
Molecular Formula:
C11H13Cl2N3O
Molecular Weight:
274.1464
MDL Number:
MFCD22201585
IUPAC Name:
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine;hydrochloride
InChI:
InChI=1S/C11H12ClN3O.ClH/c12-9-5-3-8(4-6-9)11-14-10(16-15-11)2-1-7-13;/h3-6H,1-2,7,13H2;1H
InChI Key:
JILKZXWLRMLACG-UHFFFAOYSA-N
SMILES:
NCCCc1onc(n1)c1ccc(cc1)Cl.Cl
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.044g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
274.145g/mol
Monoisotopic Mass:
273.044g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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