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1674389-96-8 | 5-(3-(Aminomethyl)-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one hydrochloride
CAS No: 1674389-96-8 Catalog No: AG01FLWO MDL No:MFCD28388797
Product Description
Catalog Number:
AG01FLWO
Chemical Name:
5-(3-(Aminomethyl)-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one hydrochloride
CAS Number:
1674389-96-8
Molecular Formula:
C7H11ClN4O2
Molecular Weight:
218.6408
MDL Number:
MFCD28388797
IUPAC Name:
5-[3-(aminomethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-2-one;hydrochloride
InChI:
InChI=1S/C7H10N4O2.ClH/c8-3-5-10-7(13-11-5)4-1-2-6(12)9-4;/h4H,1-3,8H2,(H,9,12);1H
InChI Key:
ANKHIKCCFDDLLG-UHFFFAOYSA-N
SMILES:
NCc1nc(on1)C1CCC(=O)N1.Cl
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.057g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
218.641g/mol
Monoisotopic Mass:
218.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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